MetaADEDB 2.0 @ LMMD
poncirin
(NLAWPKPYBMEWIR-SKYQDXIQSA-N)
Structure
SMILES
OC[C@H]1O[C@@H](Oc2cc3O[C@@H](CC(=O)c3c(c2)O)c2ccc(cc2)OC)[C@@H]([C@H]([C@@H]1O)O)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O
Molecular Formula:
C28H34O14
Molecular Weight:
594.561
Log P:
-0.8622
Hydrogen Bond Acceptor:
14
Hydrogen Bond Donor:
7
TPSA:
214.06
CAS Number(s):
14941-08-3
Synonym(s)
1.
poncirin
External Link(s)
MeSHC119641
PubChem Compound442456
ChEBI66773
CHEMBLCHEMBL451050
KEGGcpd:C09830
ZINC8234320
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Gastritis28013186CTD
2Seizures20362043CTD
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