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

Details

Stereochemistry ABSOLUTE
Molecular Formula C29H44O3
Molecular Weight 440.6579
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,17.BETA.-ESTRADIOL-3-METHYLETHER-17-DECANOATE

SMILES

CCCCCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=C(C=CC(OC)=C4)[C@H]3CC[C@]12C

InChI

InChIKey=XXXNFLRIRGXPDQ-GVGNIZHQSA-N
InChI=1S/C29H44O3/c1-4-5-6-7-8-9-10-11-28(30)32-27-17-16-26-25-14-12-21-20-22(31-3)13-15-23(21)24(25)18-19-29(26,27)2/h13,15,20,24-27H,4-12,14,16-19H2,1-3H3/t24-,25-,26+,27+,29+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
3,17.BETA.-ESTRADIOL-3-METHYLETHER-17-DECANOATE
Common Name English
NANDROLONE DECANOATE IMPURITY B [EP IMPURITY]
Preferred Name English
3-METHOXYESTRA-1,3,5(10)-TRIEN-17.BETA.-YL DECANOATE
Systematic Name English
((8R,9S,13S,14S,17S)-3-METHOXY-13-METHYL-6,7,8,9,11,12,14,15,16,17-DECAHYDROCYCLOPENTA(A)PHENANTHREN-17-YL) DECANOATE
Systematic Name English
Code System Code Type Description
CAS
1042947-85-2
Created by admin on Mon Mar 31 23:34:34 GMT 2025 , Edited by admin on Mon Mar 31 23:34:34 GMT 2025
PRIMARY
FDA UNII
6T9JZF6S7A
Created by admin on Mon Mar 31 23:34:34 GMT 2025 , Edited by admin on Mon Mar 31 23:34:34 GMT 2025
PRIMARY
PUBCHEM
46781510
Created by admin on Mon Mar 31 23:34:34 GMT 2025 , Edited by admin on Mon Mar 31 23:34:34 GMT 2025
PRIMARY
EPA CompTox
DTXSID50675883
Created by admin on Mon Mar 31 23:34:34 GMT 2025 , Edited by admin on Mon Mar 31 23:34:34 GMT 2025
PRIMARY