MetaADEDB 2.0 @ LMMD
diacetoxyscirpenol
(AUGQEEXBDZWUJY-ZLJUKNTDSA-N)
Structure
SMILES
CC(=O)OC[C@]12CCC(=C[C@H]1O[C@H]1[C@@]3([C@]2(C)[C@H](OC(=O)C)[C@H]1O)CO3)C
Molecular Formula:
C19H26O7
Molecular Weight:
366.406
Log P:
1.1249
Hydrogen Bond Acceptor:
7
Hydrogen Bond Donor:
1
TPSA:
94.59
CAS Number(s):
2270-40-8
Synonym(s)
1.
diacetoxyscirpenol
2.
4,15-di-o-acetylscirpenol
3.
4,15-diacetoxyscirp-9-en-3-ol
4.
4,15-diacetoxyscirpen-3-ol
5.
NSC 141537
6.
anguidin
7.
anguidine
8.
trichothec-9-ene-3alpha, 4beta, 15-triol, 12,13-epoxy-, 4,15-diacetate
External Link(s)
MeSHC001809
PubChem Compound91518
ChEBI4478
CHEMBLCHEMBL2005379
ZINC4098261
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Anorexia28666375CTD
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