17-DEACETYL VECURONIUM

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C32H55N2O3
Molecular Weight	515.7907
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	1

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12C[C@@H]([C@H](O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CC[C@@]4([H])C[C@H](OC(C)=O)[C@H](C[C@]34C)N5CCCCC5)[N+]6(C)CCCCC6

InChI

InChIKey=VFOIZESKBJXLLL-OOJCLDBCSA-N

InChI=1S/C32H55N2O3/c1-22(35)37-29-19-23-11-12-24-25(32(23,3)21-27(29)33-15-7-5-8-16-33)13-14-31(2)26(24)20-28(30(31)36)34(4)17-9-6-10-18-34/h23-30,36H,5-21H2,1-4H3/q+1/t23-,24+,25-,26-,27-,28-,29-,30-,31-,32-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C32H54N2O3
Molecular Weight	514.7828
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:46:59 UTC 2023` Edited by `admin` on `Sat Dec 16 09:46:59 UTC 2023`
Record UNII	88NY989551
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

17-DEACETYL VECURONIUM

Common Name

English

VECURONIUM BROMIDE IMPURITY E [EP IMPURITY]

Common Name

English

17-DEACETYLVECURONIUM CATION

Common Name

English

PIPERIDINIUM, 1-((2.BETA.,3.ALPHA.,5.ALPHA.,16.BETA.,17.BETA.)-3-(ACETYLOXY)-17-HYDROXY-2-(1-PIPERIDINYL)ANDROSTAN-16-YL)-1-METHYL-

Systematic Name

English

1-(3.ALPHA.-(ACETYLOXY)-17.BETA.-HYDROXY-2.BETA.-(PIPERIDIN-1-YL)-5.ALPHA.-ANDROSTAN-16.BETA.-YL)-1-METHYLPIPERIDINIUM

Systematic Name

English

VECURONIUM BROMIDE RELATED COMPOUND B CATION

Common Name

English

Code System Code Type Description

CAS

784988-81-4

Created by admin on Sat Dec 16 09:47:00 UTC 2023 , Edited by admin on Sat Dec 16 09:47:00 UTC 2023

PRIMARY

PUBCHEM

14029406

Created by admin on Sat Dec 16 09:47:00 UTC 2023 , Edited by admin on Sat Dec 16 09:47:00 UTC 2023

PRIMARY

FDA UNII

88NY989551

Created by admin on Sat Dec 16 09:47:00 UTC 2023 , Edited by admin on Sat Dec 16 09:47:00 UTC 2023

PRIMARY

Related Record Type Details


					88NY989551

17-DEACETYL VECURONIUM

IONIC MOIETY

Related Record Type Details

5438723848

VECURONIUM

PARENT -> METABOLITE

Related Record Type Details


					7E4PHP5N1D

VECURONIUM BROMIDE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: