MetaADEDB 2.0 @ LMMD
alisol A 24-acetate
(WXHUQVMHWUQNTG-JSWHPQHOSA-N)
Structure
SMILES
CC(=O)O[C@@H](C(O)(C)C)[C@H](C[C@H](C1=C2C[C@H](O)[C@@H]3[C@]([C@]2(CC1)C)(C)CC[C@@H]1[C@]3(C)CCC(=O)C1(C)C)C)O
Molecular Formula:
C32H52O6
Molecular Weight:
532.752
Log P:
5.3653
Hydrogen Bond Acceptor:
6
Hydrogen Bond Donor:
3
TPSA:
104.06
CAS Number(s):
18674-16-3
Synonym(s)
1.
alisol A 24-acetate
2.
24-acetylalisol A
External Link(s)
MeSHC457233
PubChem Compound76336194
CHEMBLCHEMBL3121587
ZINC26826463
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Hepatitis B16858666CTD
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