MetaADEDB 2.0 @ LMMD
astringin
(PERPNFLGJXUDDW-CUYWLFDKSA-N)
Structure
SMILES
OC[C@H]1O[C@@H](Oc2cc(/C=C/c3ccc(c(c3)O)O)cc(c2)O)[C@@H]([C@H]([C@@H]1O)O)O
Molecular Formula:
C20H22O9
Molecular Weight:
406.383
Log P:
0.1525
Hydrogen Bond Acceptor:
9
Hydrogen Bond Donor:
7
TPSA:
160.07
CAS Number(s):
29884-49-9
Synonym(s)
1.
astringin
2.
trans-astringin
External Link(s)
MeSHC121481
PubChem Compound5281712
ChEBI2899
CHEMBLCHEMBL358769
KEGGcpd:C10245
ZINC4098622
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Liver diseases22022464CTD
2Mammary Neoplasms, Experimental11962253CTD
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