Name: Resinacein D
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HIT ID:HIT218832763
Cas No:
Common Name:Resinacein D
IUPAC:6-{7,10-dihydroxy-3a,6,6,9a,11a-pentamethyl-4-oxo-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl}-2-methylhept-2-enoic acid
IUPAC:6-{7,10-dihydroxy-3a,6,6,9a,11a-pentamethyl-4-oxo-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl}-2-methylhept-2-enoic acid
InChIKey:QBAAQLPBKJNUHF-UHFFFAOYSA-N

Molecular Formula:C30H46O5
Molecular Weight:486.693
Hydrogen Bond Donor (HBD):
Hydrogen Bond Acceptor (HBA):
LogP:
SMILES:CC(CCC=C(C)C(O)=O)C1CCC2(C)C3=C(C(O)CC12C)C1(C)CCC(O)C(C)(C)C1CC3=O
SMILES:CC(CCC=C(C)C(O)=O)C1CCC2(C)C3=C(C(O)CC12C)C1(C)CCC(O)C(C)(C)C1CC3=O

Resinacein D is a natural product that can be used as a reference standard. The CAS number of Resinacein D is 2231061-47-3.

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