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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H30O2
Molecular Weight 290.4403
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-ANDROSTENEDIOL

SMILES

[H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CC[C@@]4([H])C[C@@H](O)C=C[C@]34C

InChI

InChIKey=RZFGPAMUAXASRE-YSZCXEEOSA-N
InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,12-17,20-21H,3-6,8,10-11H2,1-2H3/t12-,13-,14-,15-,16-,17-,18-,19-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H30O2
Molecular Weight 290.4403
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:27:29 GMT 2023
Edited
by admin
on Sat Dec 16 10:27:29 GMT 2023
Record UNII
V7W74907I7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-ANDROSTENEDIOL
Systematic Name English
J1.958.985D
Code English
ANDROST-1-ENE-3,17-DIOL, (3.BETA.,5.ALPHA.,17.BETA.)-
Systematic Name English
5.ALPHA.-ANDROST-1-ENE-3.BETA.,17.BETA.-DIOL
Systematic Name English
3.BETA.,17.BETA.-DIHYDROXY-5.ALPHA.-ANDROST-1-ENE
Systematic Name English
Classification Tree Code System Code
DEA NO. 4000
Created by admin on Sat Dec 16 10:27:29 GMT 2023 , Edited by admin on Sat Dec 16 10:27:29 GMT 2023
Code System Code Type Description
WIKIPEDIA
1-ANDROSTENEDIOL
Created by admin on Sat Dec 16 10:27:29 GMT 2023 , Edited by admin on Sat Dec 16 10:27:29 GMT 2023
PRIMARY
EPA CompTox
DTXSID60627737
Created by admin on Sat Dec 16 10:27:29 GMT 2023 , Edited by admin on Sat Dec 16 10:27:29 GMT 2023
PRIMARY
CAS
5323-27-3
Created by admin on Sat Dec 16 10:27:29 GMT 2023 , Edited by admin on Sat Dec 16 10:27:29 GMT 2023
PRIMARY
DRUG BANK
DB01503
Created by admin on Sat Dec 16 10:27:29 GMT 2023 , Edited by admin on Sat Dec 16 10:27:29 GMT 2023
PRIMARY
PUBCHEM
11300765
Created by admin on Sat Dec 16 10:27:29 GMT 2023 , Edited by admin on Sat Dec 16 10:27:29 GMT 2023
PRIMARY
FDA UNII
V7W74907I7
Created by admin on Sat Dec 16 10:27:29 GMT 2023 , Edited by admin on Sat Dec 16 10:27:29 GMT 2023
PRIMARY