U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C21H32O5S
Molecular Weight 396.541
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PREGNENOLONE SULFATE

SMILES

[H][C@@]12CC[C@H](C(C)=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CC=C4C[C@H](CC[C@]34C)OS(O)(=O)=O

InChI

InChIKey=DIJBBUIOWGGQOP-QGVNFLHTSA-N
InChI=1S/C21H32O5S/c1-13(22)17-6-7-18-16-5-4-14-12-15(26-27(23,24)25)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,15-19H,5-12H2,1-3H3,(H,23,24,25)/t15-,16-,17+,18-,19-,20-,21+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
PREGNENOLONE SULFATE
Common Name English
PREGN-5-EN-20-ONE, 3-(SULFOOXY)-, (3.BETA.)-
Systematic Name English
Code System Code Type Description
MESH
C018370
Created by admin on Sat Dec 16 10:03:36 UTC 2023 , Edited by admin on Sat Dec 16 10:03:36 UTC 2023
PRIMARY
CHEBI
133000
Created by admin on Sat Dec 16 10:03:36 UTC 2023 , Edited by admin on Sat Dec 16 10:03:36 UTC 2023
PRIMARY
WIKIPEDIA
PREGNENOLONE SULFATE
Created by admin on Sat Dec 16 10:03:36 UTC 2023 , Edited by admin on Sat Dec 16 10:03:36 UTC 2023
PRIMARY
EPA CompTox
DTXSID60924910
Created by admin on Sat Dec 16 10:03:36 UTC 2023 , Edited by admin on Sat Dec 16 10:03:36 UTC 2023
PRIMARY
FDA UNII
04Y4D91RG0
Created by admin on Sat Dec 16 10:03:36 UTC 2023 , Edited by admin on Sat Dec 16 10:03:36 UTC 2023
PRIMARY
CAS
1247-64-9
Created by admin on Sat Dec 16 10:03:36 UTC 2023 , Edited by admin on Sat Dec 16 10:03:36 UTC 2023
PRIMARY
CHEBI
35420
Created by admin on Sat Dec 16 10:03:36 UTC 2023 , Edited by admin on Sat Dec 16 10:03:36 UTC 2023
PRIMARY
PUBCHEM
105074
Created by admin on Sat Dec 16 10:03:36 UTC 2023 , Edited by admin on Sat Dec 16 10:03:36 UTC 2023
PRIMARY