MetaADEDB 2.0 @ LMMD
3-hydroxypregnan-3-one 3-sulfate
(MENQCIVHHONJLU-FZCSVUEKSA-N)
Structure
SMILES
CC(=O)[C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC[C@@H]2[C@]1(C)CC[C@@H](C2)OS(=O)(=O)O
Molecular Formula:
C21H34O5S
Molecular Weight:
398.557
Log P:
5.5031
Hydrogen Bond Acceptor:
5
Hydrogen Bond Donor:
1
TPSA:
89.05
CAS Number(s):
7730-00-9
Synonym(s)
1.
3-hydroxypregnan-3-one 3-sulfate
2.
3 alpha-hydroxy-5alpha-pregnan-20-one sulfate
3.
3 beta-hydroxy-5alpha-pregnan-20-one 3-sulfate
4.
3-hydroxypregnan-3-one 3-sulfate, (3alpha,5alpha)-isomer
5.
3-hydroxypregnan-3-one 3-sulfate, (3alpha,5beta)-isomer
6.
3-hydroxypregnan-3-one 3-sulfate, (3beta)-isomer
7.
HPOS
External Link(s)
MeSHC019427
PubChem Compound3080643
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Seizures9262314CTD
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