17.ALPHA.-ESTRADIOL 17-ACETATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H26O3
Molecular Weight	314.4186
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 17.ALPHA.-ESTRADIOL 17-ACETATE

Structure Search

SMILES

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

InChI

InChIKey=QAHOQNJVHDHYRN-OBKDMQGPSA-N

InChI=1S/C20H26O3/c1-12(21)23-19-8-7-18-17-5-3-13-11-14(22)4-6-15(13)16(17)9-10-20(18,19)2/h4,6,11,16-19,22H,3,5,7-10H2,1-2H3/t16-,17-,18+,19-,20+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C20H26O3
Molecular Weight	314.4186
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 `Sat Dec 16 01:21:11 GMT 2023` Edited by `admin` on `Sat Dec 16 01:21:11 GMT 2023`
Record UNII	6Q56E8Z1TM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

17.ALPHA.-ESTRADIOL 17-ACETATE

Common Name

English

17.ALPHA.-ESTRADIOL, 17-ACETATE

Common Name

English

ESTRA-1,3,5(10)-TRIENE-3,17-DIOL, 17-ACETATE, (17.ALPHA.)-

Systematic Name

English

Code System Code Type Description

FDA UNII

6Q56E8Z1TM

Created by admin on Sat Dec 16 01:21:12 GMT 2023 , Edited by admin on Sat Dec 16 01:21:12 GMT 2023

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CAS

15068-99-2

Created by admin on Sat Dec 16 01:21:11 GMT 2023 , Edited by admin on Sat Dec 16 01:21:11 GMT 2023

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PUBCHEM

12679334

Created by admin on Sat Dec 16 01:21:12 GMT 2023 , Edited by admin on Sat Dec 16 01:21:12 GMT 2023

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EPA CompTox

DTXSID00164590

Created by admin on Sat Dec 16 01:21:12 GMT 2023 , Edited by admin on Sat Dec 16 01:21:12 GMT 2023

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