Muvalaplin

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C42H54N4O6
Molecular Weight	710.9014
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]1(CCNC1)[C@H](CC2=CC(CN(CC3=CC(C[C@H](C(O)=O)[C@@]4([H])CCNC4)=CC=C3)CC5=CC(C[C@H](C(O)=O)[C@@]6([H])CCNC6)=CC=C5)=CC=C2)C(O)=O

InChI

InChIKey=BRLGERLDHZRETI-BGBFCPIGSA-N

InChI=1S/C42H54N4O6/c47-40(48)37(34-10-13-43-22-34)19-28-4-1-7-31(16-28)25-46(26-32-8-2-5-29(17-32)20-38(41(49)50)35-11-14-44-23-35)27-33-9-3-6-30(18-33)21-39(42(51)52)36-12-15-45-24-36/h1-9,16-18,34-39,43-45H,10-15,19-27H2,(H,47,48)(H,49,50)(H,51,52)/t34-,35-,36-,37-,38-,39-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C42H54N4O6
Molecular Weight	710.9014
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:00:08 UTC 2023` Edited by `admin` on `Sat Dec 16 19:00:08 UTC 2023`
Record UNII	HSU2KY4EFK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Muvalaplin

Official Name

English

(2S,2'S,2''S)-3,3',3''-((nitrilotris(methylene))tris(benzene-3,1-diyl))tris(2-((R)-pyrrolidin-3-yl)propanoic acid)

Systematic Name

English

3-Pyrrolidineacetic acid, α,α',α''- [nitrilotris(methylene-3,1-phenylenemethylene)]tris-, (αS,α'S,α''S,3R,3'R,3''R)-

Systematic Name

English

(2S)-3-[3-[[bis[[3-[(2S)-2-carboxy-2-[(3R)-pyrrolidin-3-yl]ethyl]phenyl]methyl]amino]phenyl]-2-[(3R)-pyrrolidin-3-yl]propanoic acid

Systematic Name

English

MUVALAPLIN [USAN]

Common Name

English

LY3473329

Code

English

LY-3473329

Code

English

muvalaplin [INN]

Common Name

English

Code System Code Type Description

INN

12607