NORETHYNODIOL 17-MONOACETATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H30O3
Molecular Weight	342.4718
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of NORETHYNODIOL 17-MONOACETATE

Structure Search

SMILES

[H][C@@]12CC[C@@](OC(C)=O)(C#C)[C@@]1(C)CC[C@]3([H])[C@@]4([H])CC[C@H](O)C=C4CC[C@@]23[H]

InChI

InChIKey=WJCWCFAFTXVJQT-KAKDVIIHSA-N

InChI=1S/C22H30O3/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/h1,13,16-20,24H,5-12H2,2-3H3/t16-,17-,18+,19+,20-,21-,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H30O3
Molecular Weight	342.4718
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:47:47 GMT 2023` Edited by `admin` on `Fri Dec 15 15:47:47 GMT 2023`
Record UNII	A0NDE4O43N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NORETHYNODIOL 17-MONOACETATE

Common Name

English

19-NORPREGN-4-EN-20-YNE-3,17-DIOL, 17-ACETATE, (3.BETA.,17.ALPHA.)-

Common Name

English

SC-12222

Code

English

Code System Code Type Description

PUBCHEM

42610385

Created by admin on Fri Dec 15 15:47:47 GMT 2023 , Edited by admin on Fri Dec 15 15:47:47 GMT 2023

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CAS

2061-46-3

Created by admin on Fri Dec 15 15:47:47 GMT 2023 , Edited by admin on Fri Dec 15 15:47:47 GMT 2023

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EPA CompTox

DTXSID20942796

Created by admin on Fri Dec 15 15:47:47 GMT 2023 , Edited by admin on Fri Dec 15 15:47:47 GMT 2023

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FDA UNII

A0NDE4O43N

Created by admin on Fri Dec 15 15:47:47 GMT 2023 , Edited by admin on Fri Dec 15 15:47:47 GMT 2023

PRIMARY