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

Details

Stereochemistry ABSOLUTE
Molecular Formula C22H26O3
Molecular Weight 338.44
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6,7-DEHYDRO NORETHINDRONE ACETATE

SMILES

[H][C@@]12CC[C@@](OC(C)=O)(C#C)[C@@]1(C)CC[C@]3([H])[C@@]4([H])CCC(=O)C=C4C=C[C@@]23[H]

InChI

InChIKey=DQSVONCNGQQILU-ZCPXKWAGSA-N
InChI=1S/C22H26O3/c1-4-22(25-14(2)23)12-10-20-19-7-5-15-13-16(24)6-8-17(15)18(19)9-11-21(20,22)3/h1,5,7,13,17-20H,6,8-12H2,2-3H3/t17-,18+,19+,20-,21-,22-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
6,7-DEHYDRO NORETHINDRONE ACETATE
Common Name English
19-NOR-17.ALPHA.-PREGNA-4,6-DIEN-20-YN-3-ONE, 17-HYDROXY-, ACETATE
Systematic Name English
19-NOR-17-ALPHA-PREGNA-4,6-DIEN-20-YN-3-ONE, 17-HYDROXY-, ACETATE
Common Name English
Code System Code Type Description
PUBCHEM
3065098
Created by admin on Sat Dec 16 18:38:17 UTC 2023 , Edited by admin on Sat Dec 16 18:38:17 UTC 2023
PRIMARY
EPA CompTox
DTXSID00910110
Created by admin on Sat Dec 16 18:38:17 UTC 2023 , Edited by admin on Sat Dec 16 18:38:17 UTC 2023
PRIMARY
CAS
106765-04-2
Created by admin on Sat Dec 16 18:38:17 UTC 2023 , Edited by admin on Sat Dec 16 18:38:17 UTC 2023
PRIMARY
FDA UNII
CP4TBM4VMG
Created by admin on Sat Dec 16 18:38:17 UTC 2023 , Edited by admin on Sat Dec 16 18:38:17 UTC 2023
PRIMARY
RS_ITEM_NUM
1166535
Created by admin on Sat Dec 16 18:38:17 UTC 2023 , Edited by admin on Sat Dec 16 18:38:17 UTC 2023
PRIMARY