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Phenanthrenes and derivatives

Polycyclic aromatic hydrocarbon compounds that consist of fourteen carbon atoms and ten hydrogen atoms fused into three benzene rings. Includes compounds that are derived from phenanthrenes.
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1

2,3,6,7,10,11-Hexahydroxytriphenylene, Spectrum™ Chemical
SDP

CAS: 4877-80-9 Molecular Formula: C18H12O6 Molecular Weight (g/mol): 324.29 InChI Key: QMLILIIMKSKLES-UHFFFAOYSA-N IUPAC Name: triphenylene-2,3,6,7,10,11-hexol SMILES: OC1=C(O)C=C2C(=C1)C1=CC(O)=C(O)C=C1C1=CC(O)=C(O)C=C21

CAS 4877-80-9
Molecular Weight (g/mol) 324.29
SMILES OC1=C(O)C=C2C(=C1)C1=CC(O)=C(O)C=C1C1=CC(O)=C(O)C=C21
IUPAC Name triphenylene-2,3,6,7,10,11-hexol
InChI Key QMLILIIMKSKLES-UHFFFAOYSA-N
Molecular Formula C18H12O6
2

9,10-Dihydrophenanthrene 96.0+%, TCI America™

CAS: 776-35-2 Molecular Formula: C14H12 Molecular Weight (g/mol): 180.25 MDL Number: MFCD00001164 InChI Key: XXPBFNVKTVJZKF-UHFFFAOYSA-N Synonym: phenanthrene, 9,10-dihydro,unii-brm9tu2f34,9,10-dihydro-phenanthrene,dihydrophenanthrene,brm9tu2f34,acmc-1ba4q,phenanthrene,9,10-dihydro,9,10-dihydrophenanthrene,phenanthrene, 9,10-dihydro-8ci 9ci PubChem CID: 13058 IUPAC Name: 9,10-dihydrophenanthrene SMILES: C1CC2=CC=CC=C2C3=CC=CC=C31

PubChem CID 13058
CAS 776-35-2
Molecular Weight (g/mol) 180.25
MDL Number MFCD00001164
SMILES C1CC2=CC=CC=C2C3=CC=CC=C31
Synonym phenanthrene, 9,10-dihydro,unii-brm9tu2f34,9,10-dihydro-phenanthrene,dihydrophenanthrene,brm9tu2f34,acmc-1ba4q,phenanthrene,9,10-dihydro,9,10-dihydrophenanthrene,phenanthrene, 9,10-dihydro-8ci 9ci
IUPAC Name 9,10-dihydrophenanthrene
InChI Key XXPBFNVKTVJZKF-UHFFFAOYSA-N
Molecular Formula C14H12
3

2,3,6,7,10,11-Hexabromotriphenylene 98.0+%, TCI America™

CAS: 82632-80-2 Molecular Formula: C18H6Br6 Molecular Weight (g/mol): 701.67 InChI Key: GLHQUXLCQLQNPZ-UHFFFAOYSA-N PubChem CID: 11083045 IUPAC Name: 2,3,6,7,10,11-hexabromotriphenylene SMILES: C1=C2C3=CC(=C(C=C3C4=CC(=C(C=C4C2=CC(=C1Br)Br)Br)Br)Br)Br

PubChem CID 11083045
CAS 82632-80-2
Molecular Weight (g/mol) 701.67
SMILES C1=C2C3=CC(=C(C=C3C4=CC(=C(C=C4C2=CC(=C1Br)Br)Br)Br)Br)Br
IUPAC Name 2,3,6,7,10,11-hexabromotriphenylene
InChI Key GLHQUXLCQLQNPZ-UHFFFAOYSA-N
Molecular Formula C18H6Br6
4

2,7-Dibromophenanthrene-9,10-dione 97.0+%, TCI America™

CAS: 84405-44-7 Molecular Formula: C14H6Br2O2 Molecular Weight (g/mol): 366.01 MDL Number: MFCD03931078 InChI Key: LTZIIBSPYWTOQV-UHFFFAOYSA-N PubChem CID: 265843 IUPAC Name: 2,7-dibromo-9,10-dihydrophenanthrene-9,10-dione SMILES: BrC1=CC=C2C3=CC=C(Br)C=C3C(=O)C(=O)C2=C1

PubChem CID 265843
CAS 84405-44-7
Molecular Weight (g/mol) 366.01
MDL Number MFCD03931078
SMILES BrC1=CC=C2C3=CC=C(Br)C=C3C(=O)C(=O)C2=C1
IUPAC Name 2,7-dibromo-9,10-dihydrophenanthrene-9,10-dione
InChI Key LTZIIBSPYWTOQV-UHFFFAOYSA-N
Molecular Formula C14H6Br2O2
5

2,3,6,7,10,11-Hexamethoxytriphenylene 95.0+%, TCI America™

CAS: 808-57-1 Molecular Formula: C24H24O6 Molecular Weight (g/mol): 408.45 MDL Number: MFCD00075571 InChI Key: TXROZCSFVVIBFI-UHFFFAOYSA-N PubChem CID: 4607363 IUPAC Name: 2,3,6,7,10,11-hexamethoxytriphenylene SMILES: COC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)OC)OC)OC)OC)OC

PubChem CID 4607363
CAS 808-57-1
Molecular Weight (g/mol) 408.45
MDL Number MFCD00075571
SMILES COC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)OC)OC)OC)OC)OC
IUPAC Name 2,3,6,7,10,11-hexamethoxytriphenylene
InChI Key TXROZCSFVVIBFI-UHFFFAOYSA-N
Molecular Formula C24H24O6
6

2,3,6,7,10,11-Hexahydroxytriphenylene Hydrate 95.0+%, TCI America™

CAS: 4877-80-9 Molecular Formula: C18H12O6 Molecular Weight (g/mol): 324.288 MDL Number: MFCD01321170 InChI Key: QMLILIIMKSKLES-UHFFFAOYSA-N Synonym: 2,3,6,7,10,11-hexahydroxytriphenylene,triphenylene-2,3,6,7,10,11-hexaol,2,3,6,7,10,11-triphenylenehexol,acmc-1ak9f,2,3,6,7,10,11-hexa-hydroxytriphenylene PubChem CID: 11088610 IUPAC Name: triphenylene-2,3,6,7,10,11-hexol SMILES: C1=C2C3=CC(=C(C=C3C4=CC(=C(C=C4C2=CC(=C1O)O)O)O)O)O

PubChem CID 11088610
CAS 4877-80-9
Molecular Weight (g/mol) 324.288
MDL Number MFCD01321170
SMILES C1=C2C3=CC(=C(C=C3C4=CC(=C(C=C4C2=CC(=C1O)O)O)O)O)O
Synonym 2,3,6,7,10,11-hexahydroxytriphenylene,triphenylene-2,3,6,7,10,11-hexaol,2,3,6,7,10,11-triphenylenehexol,acmc-1ak9f,2,3,6,7,10,11-hexa-hydroxytriphenylene
IUPAC Name triphenylene-2,3,6,7,10,11-hexol
InChI Key QMLILIIMKSKLES-UHFFFAOYSA-N
Molecular Formula C18H12O6
7

2,3,6,7,10,11-Hexakis(hexyloxy)triphenylene 98.0+%, TCI America™

CAS: 70351-86-9 Molecular Formula: C54H84O6 Molecular Weight (g/mol): 829.26 MDL Number: MFCD16250223 InChI Key: SQYCPYUKCAKHRN-UHFFFAOYSA-N PubChem CID: 10941839 IUPAC Name: 2,3,6,7,10,11-hexakis(hexyloxy)triphenylene SMILES: CCCCCCOC1=C(OCCCCCC)C=C2C(=C1)C1=CC(OCCCCCC)=C(OCCCCCC)C=C1C1=CC(OCCCCCC)=C(OCCCCCC)C=C21

PubChem CID 10941839
CAS 70351-86-9
Molecular Weight (g/mol) 829.26
MDL Number MFCD16250223
SMILES CCCCCCOC1=C(OCCCCCC)C=C2C(=C1)C1=CC(OCCCCCC)=C(OCCCCCC)C=C1C1=CC(OCCCCCC)=C(OCCCCCC)C=C21
IUPAC Name 2,3,6,7,10,11-hexakis(hexyloxy)triphenylene
InChI Key SQYCPYUKCAKHRN-UHFFFAOYSA-N
Molecular Formula C54H84O6
8

2,3,6,7,10,11-Hexakis[(n-octyl)oxy]triphenylene 98.0+%, TCI America™

CAS: 70351-87-0 Molecular Formula: C66H108O6 Molecular Weight (g/mol): 997.58 MDL Number: MFCD20528916 InChI Key: IUFDADHEWRYRSP-UHFFFAOYSA-N PubChem CID: 15219108 IUPAC Name: 2,3,6,7,10,11-hexakis(octyloxy)triphenylene SMILES: CCCCCCCCOC1=C(OCCCCCCCC)C=C2C(=C1)C1=CC(OCCCCCCCC)=C(OCCCCCCCC)C=C1C1=CC(OCCCCCCCC)=C(OCCCCCCCC)C=C21

PubChem CID 15219108
CAS 70351-87-0
Molecular Weight (g/mol) 997.58
MDL Number MFCD20528916
SMILES CCCCCCCCOC1=C(OCCCCCCCC)C=C2C(=C1)C1=CC(OCCCCCCCC)=C(OCCCCCCCC)C=C1C1=CC(OCCCCCCCC)=C(OCCCCCCCC)C=C21
IUPAC Name 2,3,6,7,10,11-hexakis(octyloxy)triphenylene
InChI Key IUFDADHEWRYRSP-UHFFFAOYSA-N
Molecular Formula C66H108O6
9

Triphenylene 96.0+%, TCI America™

CAS: 217-59-4 Molecular Formula: C18H12 Molecular Weight (g/mol): 228.29 MDL Number: MFCD00001108 InChI Key: SLGBZMMZGDRARJ-UHFFFAOYSA-N Synonym: 9,10-benzophenanthrene,isochrysene,9,10-benzphenanthrene,benzo l phenanthrene,1,2,3,4-dibenznaphthalene,benzophenanthrene,1,2:3,4-dibenznaphthalene,ccris 1301,triphenylen-1-yl PubChem CID: 9170 ChEBI: CHEBI:33080 IUPAC Name: triphenylene SMILES: C1=CC=C2C(=C1)C1=CC=CC=C1C1=CC=CC=C21

PubChem CID 9170
CAS 217-59-4
Molecular Weight (g/mol) 228.29
ChEBI CHEBI:33080
MDL Number MFCD00001108
SMILES C1=CC=C2C(=C1)C1=CC=CC=C1C1=CC=CC=C21
Synonym 9,10-benzophenanthrene,isochrysene,9,10-benzphenanthrene,benzo l phenanthrene,1,2,3,4-dibenznaphthalene,benzophenanthrene,1,2:3,4-dibenznaphthalene,ccris 1301,triphenylen-1-yl
IUPAC Name triphenylene
InChI Key SLGBZMMZGDRARJ-UHFFFAOYSA-N
Molecular Formula C18H12
10

Triphenylene (purified by sublimation) 98.0+%, TCI America™

CAS: 217-59-4 Molecular Formula: C18H12 Molecular Weight (g/mol): 228.29 MDL Number: MFCD00001108 InChI Key: SLGBZMMZGDRARJ-UHFFFAOYSA-N Synonym: 9,10-benzophenanthrene,isochrysene,9,10-benzphenanthrene,benzo l phenanthrene,1,2,3,4-dibenznaphthalene,benzophenanthrene,1,2:3,4-dibenznaphthalene,ccris 1301,triphenylen-1-yl PubChem CID: 9170 ChEBI: CHEBI:33080 IUPAC Name: triphenylene SMILES: C1=CC=C2C(=C1)C1=CC=CC=C1C1=CC=CC=C21

PubChem CID 9170
CAS 217-59-4
Molecular Weight (g/mol) 228.29
ChEBI CHEBI:33080
MDL Number MFCD00001108
SMILES C1=CC=C2C(=C1)C1=CC=CC=C1C1=CC=CC=C21
Synonym 9,10-benzophenanthrene,isochrysene,9,10-benzphenanthrene,benzo l phenanthrene,1,2,3,4-dibenznaphthalene,benzophenanthrene,1,2:3,4-dibenznaphthalene,ccris 1301,triphenylen-1-yl
IUPAC Name triphenylene
InChI Key SLGBZMMZGDRARJ-UHFFFAOYSA-N
Molecular Formula C18H12
11

2,3,6,7,10,11-Hexahydroxytriphenylene, 95%

CAS: 4877-80-9 Molecular Formula: C18H12O6 Molecular Weight (g/mol): 324.29 InChI Key: QMLILIIMKSKLES-UHFFFAOYSA-N Synonym: 2,3,6,7,10,11-hexahydroxytriphenylene,triphenylene-2,3,6,7,10,11-hexaol,2,3,6,7,10,11-triphenylenehexol,acmc-1ak9f,2,3,6,7,10,11-hexa-hydroxytriphenylene PubChem CID: 11088610 IUPAC Name: triphenylene-2,3,6,7,10,11-hexol SMILES: C1=C2C3=CC(=C(C=C3C4=CC(=C(C=C4C2=CC(=C1O)O)O)O)O)O

PubChem CID 11088610
CAS 4877-80-9
Molecular Weight (g/mol) 324.29
SMILES C1=C2C3=CC(=C(C=C3C4=CC(=C(C=C4C2=CC(=C1O)O)O)O)O)O
Synonym 2,3,6,7,10,11-hexahydroxytriphenylene,triphenylene-2,3,6,7,10,11-hexaol,2,3,6,7,10,11-triphenylenehexol,acmc-1ak9f,2,3,6,7,10,11-hexa-hydroxytriphenylene
IUPAC Name triphenylene-2,3,6,7,10,11-hexol
InChI Key QMLILIIMKSKLES-UHFFFAOYSA-N
Molecular Formula C18H12O6
12

Carnosic Acid 97.0+%, TCI America™

CAS: 3650-09-7 Molecular Formula: C20H28O4 Molecular Weight (g/mol): 332.44 MDL Number: MFCD02259459 InChI Key: QRYRORQUOLYVBU-VBKZILBWSA-N Synonym: (4aR,10aS)-5,6-Dihydroxy-7-isopropyl-1,1-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-4a-carboxylic Acid PubChem CID: 65126 ChEBI: CHEBI:65585 IUPAC Name: (4aR,10aS)-5,6-dihydroxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid SMILES: CC(C)C1=C(C(=C2C(=C1)CCC3C2(CCCC3(C)C)C(=O)O)O)O

PubChem CID 65126
CAS 3650-09-7
Molecular Weight (g/mol) 332.44
ChEBI CHEBI:65585
MDL Number MFCD02259459
SMILES CC(C)C1=C(C(=C2C(=C1)CCC3C2(CCCC3(C)C)C(=O)O)O)O
Synonym (4aR,10aS)-5,6-Dihydroxy-7-isopropyl-1,1-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-4a-carboxylic Acid
IUPAC Name (4aR,10aS)-5,6-dihydroxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid
InChI Key QRYRORQUOLYVBU-VBKZILBWSA-N
Molecular Formula C20H28O4
13

Violanthrone 79 95.0+%, TCI America™

CAS: 85652-50-2 Molecular Formula: C50H48O4 Molecular Weight (g/mol): 712.93 MDL Number: MFCD00491570 InChI Key: LLPQZABTDLOYAL-UHFFFAOYSA-N Synonym: violanthrone-79,violanthrone 79,anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy,anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,1,16,17-bis n-octyloxy anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy-anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy anthra 9,1,2-cde-benzo rst pentaphene-5,10-dione,16,17-bis octyloxy anthra 9,1,2-cde benzo rst pentaphene-5,10-dione PubChem CID: 16217791 SMILES: CCCCCCCCOC1=C2C3=C(C=CC4=C3C(=C1)C5=CC=CC=C5C4=O)C6=C7C2=C(C=C8C7=C(C=C6)C(=O)C9=CC=CC=C98)OCCCCCCCC

PubChem CID 16217791
CAS 85652-50-2
Molecular Weight (g/mol) 712.93
MDL Number MFCD00491570
SMILES CCCCCCCCOC1=C2C3=C(C=CC4=C3C(=C1)C5=CC=CC=C5C4=O)C6=C7C2=C(C=C8C7=C(C=C6)C(=O)C9=CC=CC=C98)OCCCCCCCC
Synonym violanthrone-79,violanthrone 79,anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy,anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,1,16,17-bis n-octyloxy anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy-anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy anthra 9,1,2-cde-benzo rst pentaphene-5,10-dione,16,17-bis octyloxy anthra 9,1,2-cde benzo rst pentaphene-5,10-dione
InChI Key LLPQZABTDLOYAL-UHFFFAOYSA-N
Molecular Formula C50H48O4
14

Carnosic Acid (Synthetic) 97.0+%, TCI America™

CAS: 3650-09-7 Molecular Formula: C20H28O4 Molecular Weight (g/mol): 332.44 MDL Number: MFCD02259459 InChI Key: QRYRORQUOLYVBU-VBKZILBWSA-N Synonym: (4aR,10aS)-5,6-Dihydroxy-7-isopropyl-1,1-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-4a-carboxylic Acid PubChem CID: 65126 ChEBI: CHEBI:65585 IUPAC Name: (4aR,10aS)-5,6-dihydroxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid SMILES: CC(C)C1=C(C(=C2C(=C1)CCC3C2(CCCC3(C)C)C(=O)O)O)O

PubChem CID 65126
CAS 3650-09-7
Molecular Weight (g/mol) 332.44
ChEBI CHEBI:65585
MDL Number MFCD02259459
SMILES CC(C)C1=C(C(=C2C(=C1)CCC3C2(CCCC3(C)C)C(=O)O)O)O
Synonym (4aR,10aS)-5,6-Dihydroxy-7-isopropyl-1,1-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-4a-carboxylic Acid
IUPAC Name (4aR,10aS)-5,6-dihydroxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid
InChI Key QRYRORQUOLYVBU-VBKZILBWSA-N
Molecular Formula C20H28O4
15

TARGETMOL CHEMICALS INC HYPERICIN 5MG
SDP

Also available in 1 mg 10 mg 25 mg 50 mg 100 mg 500 mg 1 mL 10 mM (in DMSO) and bulk. Please contact Fisher for quotes. 1. Hypericin (Cyclosan) has antineoplastic activity. 2. Hypericin has antibiotic and antiviral activities. 3. Hypericin has antidepressive activity through inhibiting monoamine oxidase enzyme. 4. Hypericin inhibits RANKL-mediated osteoclastogenesis via affecting ERK signalling in vitro and suppresses wear particle-induced osteolysis in vivo. purity: 99%

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