MetaADEDB 2.0 @ LMMD
peoniflorin
(YKRGDOXKVOZESV-WRJNSLSBSA-N)
Structure
SMILES
OC[C@H]1O[C@@H](O[C@@]23C[C@@H]4[C@@]3(COC(=O)c3ccccc3)[C@@H]3O[C@@]2(C)C[C@]4(O3)O)[C@@H]([C@H]([C@@H]1O)O)O
Molecular Formula:
C23H28O11
Molecular Weight:
480.462
Log P:
-1.3575
Hydrogen Bond Acceptor:
11
Hydrogen Bond Donor:
5
TPSA:
164.37
CAS Number(s):
23180-57-6
Synonym(s)
1.
peoniflorin
2.
paeoniflorin
3.
peoniflorin sulfonate
External Link(s)
MeSHC015423
PubChem Compound442534
ChEBI7889
KEGGcpd:C09959
Therapeutic Target DatabaseD0PD0F
ZINC8234328
Adverse Drug Event(s)
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