ISTAROXIME, (E)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H32N2O3
Molecular Weight	360.4904
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CCC(=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CC(=O)[C@@]4([H])C\C(CC[C@]34C)=N\OCCN

InChI

InChIKey=MPYLDWFDPHRTEG-PAAYLBSLSA-N

InChI=1S/C21H32N2O3/c1-20-7-5-13(23-26-10-9-22)11-17(20)18(24)12-14-15-3-4-19(25)21(15,2)8-6-16(14)20/h14-17H,3-12,22H2,1-2H3/b23-13+/t14-,15-,16-,17+,20+,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H32N2O3
Molecular Weight	360.4904
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:45:24 UTC 2023` Edited by `admin` on `Sat Dec 16 15:45:24 UTC 2023`
Record UNII	W40687GO3S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISTAROXIME, (E)-

Common Name

English

ANDROSTANE-3,6,17-TRIONE, 3-(O-(2-AMINOETHYL)OXIME), (3E,5.ALPHA.)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

9841834

Created by admin on Sat Dec 16 15:45:24 UTC 2023 , Edited by admin on Sat Dec 16 15:45:24 UTC 2023

PRIMARY

FDA UNII

W40687GO3S

Created by admin on Sat Dec 16 15:45:24 UTC 2023 , Edited by admin on Sat Dec 16 15:45:24 UTC 2023

PRIMARY

CAS

203738-46-9

Created by admin on Sat Dec 16 15:45:24 UTC 2023 , Edited by admin on Sat Dec 16 15:45:24 UTC 2023

PRIMARY

EPA CompTox

DTXSID20870222

Created by admin on Sat Dec 16 15:45:24 UTC 2023 , Edited by admin on Sat Dec 16 15:45:24 UTC 2023

PRIMARY

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