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

Details

Stereochemistry ABSOLUTE
Molecular Formula C24H34O3
Molecular Weight 370.525
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-METHYL ESTRADIOL 17-VALERATE

SMILES

[H][C@@]12CC[C@H](OC(=O)CCCC)[C@@]1(C)CC[C@]3([H])C4=C(CC[C@@]23[H])C(C)=C(O)C=C4

InChI

InChIKey=HYULKAMCRUYZJT-KVMFQRFPSA-N
InChI=1S/C24H34O3/c1-4-5-6-23(26)27-22-12-10-20-19-8-7-16-15(2)21(25)11-9-17(16)18(19)13-14-24(20,22)3/h9,11,18-20,22,25H,4-8,10,12-14H2,1-3H3/t18-,19-,20+,22+,24+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
4-METHYL ESTRADIOL 17-VALERATE
Common Name English
ESTRA-1,3,5(10)-TRIENE-3,17-DIOL, 4-METHYL-, 17-PENTANOATE, (17.BETA.)-
Systematic Name English
ESTRADIOL VALERATE IMPURITY D [EP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
71587988
Created by admin on Sat Dec 16 05:09:29 GMT 2023 , Edited by admin on Sat Dec 16 05:09:29 GMT 2023
PRIMARY
CAS
1359847-37-2
Created by admin on Sat Dec 16 05:09:29 GMT 2023 , Edited by admin on Sat Dec 16 05:09:29 GMT 2023
PRIMARY
EPA CompTox
DTXSID30159611
Created by admin on Sat Dec 16 05:09:29 GMT 2023 , Edited by admin on Sat Dec 16 05:09:29 GMT 2023
PRIMARY
FDA UNII
5PDP2ZZR0N
Created by admin on Sat Dec 16 05:09:29 GMT 2023 , Edited by admin on Sat Dec 16 05:09:29 GMT 2023
PRIMARY