Name: Ganolucidic acid B
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HIT ID:HIT218679500
Cas No:
Common Name:Ganolucidic acid B
IUPAC:6-{3,7-dihydroxy-3a,6,6,9a,11a-pentamethyl-10-oxo-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl}-2-methyl-4-oxoheptanoic acid
IUPAC:6-{3,7-dihydroxy-3a,6,6,9a,11a-pentamethyl-10-oxo-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl}-2-methyl-4-oxoheptanoic acid
InChIKey:YPYHGMCHNBTMDB-UHFFFAOYSA-N

Molecular Formula:C30H46O6
Molecular Weight:502.692
Hydrogen Bond Donor (HBD):
Hydrogen Bond Acceptor (HBA):
LogP:
SMILES:CC(CC(=O)CC(C)C(O)=O)C1CC(O)C2(C)C3=C(C(=O)CC12C)C1(C)CCC(O)C(C)(C)C1CC3
SMILES:CC(CC(=O)CC(C)C(O)=O)C1CC(O)C2(C)C3=C(C(=O)CC12C)C1(C)CCC(O)C(C)(C)C1CC3

Ganolucidic acids B demonstrated the ability to induce hPXR-mediated CYP3A4 expression.

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