A-86929 MONOACETATE 2 HYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H23NO3S.ClH
Molecular Weight	393.927
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of A-86929 MONOACETATE 2 HYDROCHLORIDE

Structure Search

SMILES

Cl.[H][C@@]12CCC3=CC(OC(C)=O)=C(O)C=C3[C@@]1([H])C4=C(CN2)SC(CCC)=C4

InChI

InChIKey=CLUKOTOCTKZQGQ-PXPMWPIZSA-N

InChI=1S/C20H23NO3S.ClH/c1-3-4-13-8-15-19(25-13)10-21-16-6-5-12-7-18(24-11(2)22)17(23)9-14(12)20(15)16;/h7-9,16,20-21,23H,3-6,10H2,1-2H3;1H/t16-,20+;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C20H23NO3S
Molecular Weight	357.467
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:39:12 GMT 2023` Edited by `admin` on `Fri Dec 15 15:39:12 GMT 2023`
Record UNII	Z26W8G4OJ2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

A-86929 MONOACETATE 2 HYDROCHLORIDE

Code

English

(-)-TRANS 9-ACETYLOXY-10-HYDROXY-2-PROPYL-4,5,5A,6,7,11B-HEXAHYDRO-3-THIA-5- AZACYCLOPENT-1-ENA(C)PHENANTHRENE HYDROCHLORIDE

Systematic Name

English

A-86929.1 MONOACETATE 2

Code

English

10-DEACETYL ADROGOLIDE HYDROCHLORIDE

Common Name

English

Code System Code Type Description

FDA UNII

Z26W8G4OJ2

Created by admin on Fri Dec 15 15:39:12 GMT 2023 , Edited by admin on Fri Dec 15 15:39:12 GMT 2023

PRIMARY

PUBCHEM

131842307

Created by admin on Fri Dec 15 15:39:12 GMT 2023 , Edited by admin on Fri Dec 15 15:39:12 GMT 2023

PRIMARY

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