PIPERIDINYL ROCURONIUM

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C32H53N2O3
Molecular Weight	513.7748
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](OC(C)=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CC[C@@]4([H])C[C@H](O)[C@H](C[C@]34C)N5CCCC5)[N+]6(CC=C)CCCC6

InChI

InChIKey=LBWBPSXAJLSPRH-OOJCLDBCSA-N

InChI=1S/C32H53N2O3/c1-5-16-34(17-8-9-18-34)28-20-26-24-11-10-23-19-29(36)27(33-14-6-7-15-33)21-32(23,4)25(24)12-13-31(26,3)30(28)37-22(2)35/h5,23-30,36H,1,6-21H2,2-4H3/q+1/t23-,24+,25-,26-,27-,28-,29-,30-,31-,32-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C32H52N2O3
Molecular Weight	512.7669
Charge	0
Count

Stereochemistry	ABSOLUTE
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 14:50:11 UTC 2023` Edited by `admin` on `Sat Dec 16 14:50:11 UTC 2023`
Record UNII	C1QY4G1ZL6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PIPERIDINYL ROCURONIUM

Common Name

English

PYRROLIDINIUM, 1-((2.BETA.,3.ALPHA.,5.ALPHA.,16.BETA.,17.BETA.)-17-(ACETYLOXY)-3-HYDROXY-2-(1-PYRROLIDINYL)ANDROSTAN-16-YL)-1-(2-PROPEN-1-YL)-

Systematic Name

English

ROCURONIUM BROMIDE IMPURITY E [EP IMPURITY]

Common Name

English

1-(17.BETA.-ACETOXY-3.ALPHA.-HYDROXY-2.BETA.-(PYRROLIDIN-1-YL)-5.ALPHA.-ANDROSTAN-16.BETA.-YL)-1-(PROP-2-ENYL)PYRROLIDINIUM

Systematic Name

English

1-((2.BETA.,3.ALPHA.,5.ALPHA.,16.BETA.,17.BETA.)-17-(ACETYLOXY)-3-HYDROXY-2-(1-PYRROLIDINYL)ANDROSTAN-16-YL)-1-(2-PROPEN-1-YL)PYRROLIDINIUM

Systematic Name

English

1-(17.BETA.-(ACETYLOXY)-3.ALPHA.-HYDROXY-2.BETA.-(PYRROLIDIN-1-YL)-5.ALPHA.-ANDROSTAN-16.BETA.-YL)-1-(PROP-2-ENYL)PYRROLIDINIUM

Systematic Name

English

ROCURONIUM RELATED COMPOUND E [USP IMPURITY]

Common Name

English

Code System Code Type Description

PUBCHEM

126455959

Created by admin on Sat Dec 16 14:50:12 UTC 2023 , Edited by admin on Sat Dec 16 14:50:12 UTC 2023

PRIMARY

FDA UNII

C1QY4G1ZL6

Created by admin on Sat Dec 16 14:50:12 UTC 2023 , Edited by admin on Sat Dec 16 14:50:12 UTC 2023

PRIMARY

CAS

942983-83-7

Created by admin on Sat Dec 16 14:50:12 UTC 2023 , Edited by admin on Sat Dec 16 14:50:12 UTC 2023

PRIMARY

Related Record Type Details


					C1QY4G1ZL6

PIPERIDINYL ROCURONIUM

IONIC MOIETY

Related Record Type Details


					I65MW4OFHZ

ROCURONIUM BROMIDE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:


					I65MW4OFHZ

ROCURONIUM BROMIDE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: