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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H30O3
Molecular Weight 306.4397
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HE-2200, 7.ALPHA.-

SMILES

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

InChI

InChIKey=OEVZKEVBDIDVOI-FMKNUBLKSA-N
InChI=1S/C19H30O3/c1-18-7-5-12(20)9-11(18)10-15(21)17-13-3-4-16(22)19(13,2)8-6-14(17)18/h10,12-17,20-22H,3-9H2,1-2H3/t12-,13-,14-,15+,16-,17-,18-,19-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
HE-2200, 7.ALPHA.-
Code English
ANDROST-5-ENE-3,7,17-TRIOL, (3.BETA.,7.ALPHA.,17.BETA.)-
Systematic Name English
3.BETA.,7.ALPHA.,17.BETA.-TRIHYDROXYANDROST-5-ENE
Systematic Name English
3.BETA.,7.ALPHA.,17.BETA.-ANDROST-5-ENETRIOL
Systematic Name English
Code System Code Type Description
FDA UNII
Q6U2P54C9B
Created by admin on Sat Dec 16 18:05:13 GMT 2023 , Edited by admin on Sat Dec 16 18:05:13 GMT 2023
PRIMARY
CAS
2226-66-6
Created by admin on Sat Dec 16 18:05:13 GMT 2023 , Edited by admin on Sat Dec 16 18:05:13 GMT 2023
PRIMARY
PUBCHEM
25108320
Created by admin on Sat Dec 16 18:05:13 GMT 2023 , Edited by admin on Sat Dec 16 18:05:13 GMT 2023
PRIMARY