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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H28O3
Molecular Weight 328.4452
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ESTRADIOL 17-PROPIONATE

SMILES

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

InChI

InChIKey=PQCRZWCSVWBYSC-AGRFSFNASA-N
InChI=1S/C21H28O3/c1-3-20(23)24-19-9-8-18-17-6-4-13-12-14(22)5-7-15(13)16(17)10-11-21(18,19)2/h5,7,12,16-19,22H,3-4,6,8-11H2,1-2H3/t16-,17-,18+,19+,21+/m1/s1

HIDE SMILES / InChI

Molecular Formula C21H28O3
Molecular Weight 328.4452
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:04:07 UTC 2023
Edited
by admin
on Fri Dec 15 15:04:07 UTC 2023
Record UNII
K31PC34297
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ESTRADIOL 17-PROPIONATE
Common Name English
1,3,5(10)-ESTRATRIENE-3,17.BETA.-DIOL 17-PROPIONATE
Systematic Name English
ESTRADIOL PROPIONATE
Common Name English
Code System Code Type Description
CAS
3758-34-7
Created by admin on Fri Dec 15 15:04:07 UTC 2023 , Edited by admin on Fri Dec 15 15:04:07 UTC 2023
PRIMARY
EPA CompTox
DTXSID4048985
Created by admin on Fri Dec 15 15:04:07 UTC 2023 , Edited by admin on Fri Dec 15 15:04:07 UTC 2023
PRIMARY
ECHA (EC/EINECS)
223-164-7
Created by admin on Fri Dec 15 15:04:07 UTC 2023 , Edited by admin on Fri Dec 15 15:04:07 UTC 2023
PRIMARY
FDA UNII
K31PC34297
Created by admin on Fri Dec 15 15:04:07 UTC 2023 , Edited by admin on Fri Dec 15 15:04:07 UTC 2023
PRIMARY
SMS_ID
100000089475
Created by admin on Fri Dec 15 15:04:07 UTC 2023 , Edited by admin on Fri Dec 15 15:04:07 UTC 2023
PRIMARY
PUBCHEM
19571
Created by admin on Fri Dec 15 15:04:07 UTC 2023 , Edited by admin on Fri Dec 15 15:04:07 UTC 2023
PRIMARY
EVMPD
SUB25453
Created by admin on Fri Dec 15 15:04:07 UTC 2023 , Edited by admin on Fri Dec 15 15:04:07 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY