CAS RN 6199-67-3
CAS RN 6199-67-3
IUPAC Name:
(3E,6R)-6-[(1R,2R,3aS,3bS,8S,9aR,9bR,11aR)-2,8-dihydroxy-3a,6,6,9b,11a-pentamethyl-7,10-dioxo-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate
Synonyms:
amarine datiscn principle B cucurbitacin b 2-sulfate datisca principle B cucurbitacine B 1,2-dihydro-α-elaterin cucurbitacin B 2-sulfate datiscacin cucurbitacin B
Molecular Weight (g/mol):
558.71
Molecular Formula:
C32H46O8
InChi Key:
IXQKXEUSCPEQRD-DKRGWESNSA-N
SMILES:
CC(=O)OC(C)(C)\C=C\C(=O)[C@](C)(O)[C@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC=C4[C@@H](C[C@H](O)C(=O)C4(C)C)[C@]3(C)C(=O)C[C@]12C
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Cucurbitacin B 98.0+%, TCI America™
CAS: 6199-67-3 Molecular Formula: C32H46O8 Molecular Weight (g/mol): 558.712 MDL Number: MFCD07778083 InChI Key: IXQKXEUSCPEQRD-DKRGWESNSA-N PubChem CID: 5281316 ChEBI: CHEBI:3941 IUPAC Name: [(E,6R)-6-[(2S,8S,9R,10R,13R,14S,16R,17R)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl] acetate SMILES: CC(=O)OC(C)(C)C=CC(=O)C(C)(C1C(CC2(C1(CC(=O)C3(C2CC=C4C3CC(C(=O)C4(C)C)O)C)C)C)O)O