U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

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 of Muvalaplin

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

Approval Year

Name Type Language
Muvalaplin
USAN  
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
Created by admin on Sat Dec 16 19:00:08 GMT 2023 , Edited by admin on Sat Dec 16 19:00:08 GMT 2023
PRIMARY
SMS_ID
300000023396
Created by admin on Sat Dec 16 19:00:08 GMT 2023 , Edited by admin on Sat Dec 16 19:00:08 GMT 2023
PRIMARY
USAN
KL-45
Created by admin on Sat Dec 16 19:00:08 GMT 2023 , Edited by admin on Sat Dec 16 19:00:08 GMT 2023
PRIMARY
FDA UNII
HSU2KY4EFK
Created by admin on Sat Dec 16 19:00:08 GMT 2023 , Edited by admin on Sat Dec 16 19:00:08 GMT 2023
PRIMARY
CAS
2565656-70-2
Created by admin on Sat Dec 16 19:00:08 GMT 2023 , Edited by admin on Sat Dec 16 19:00:08 GMT 2023
PRIMARY
PUBCHEM
155369486
Created by admin on Sat Dec 16 19:00:08 GMT 2023 , Edited by admin on Sat Dec 16 19:00:08 GMT 2023
PRIMARY
NCI_THESAURUS
C190757
Created by admin on Sat Dec 16 19:00:08 GMT 2023 , Edited by admin on Sat Dec 16 19:00:08 GMT 2023
PRIMARY