MetaADEDB 2.0 @ LMMD
niga-ichigoside F1
(WKKBYJLXSKPKSC-JVJIQXRHSA-N)
Structure
SMILES
OC[C@H]1O[C@@H](OC(=O)[C@@]23CC[C@H]([C@@]([C@H]3C3=CC[C@H]4[C@@]([C@@]3(CC2)C)(C)CC[C@@H]2[C@]4(C)C[C@H]([C@@H]([C@@]2(C)CO)O)O)(C)O)C)[C@@H]([C@H]([C@@H]1O)O)O
Molecular Formula:
C36H58O11
Molecular Weight:
666.839
Log P:
1.4061
Hydrogen Bond Acceptor:
11
Hydrogen Bond Donor:
8
TPSA:
197.37
CAS Number(s):
95262-48-9
Synonym(s)
1.
niga-ichigoside F1
External Link(s)
MeSHC090725
PubChem Compound16118969
ChEBI67917
CHEMBLCHEMBL449365
ZINC49841125
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Pain17331332CTD
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