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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H20N2O5
Molecular Weight 272.2976
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOBUTYL N-(L-ASPARTYL)-1-AMINOCYCLOPROPANECARBOXYLATE

SMILES

CC(C)COC(=O)C1(CC1)NC(=O)[C@@H](N)CC(O)=O

InChI

InChIKey=GASHANJDNYBVJM-QMMMGPOBSA-N
InChI=1S/C12H20N2O5/c1-7(2)6-19-11(18)12(3-4-12)14-10(17)8(13)5-9(15)16/h7-8H,3-6,13H2,1-2H3,(H,14,17)(H,15,16)/t8-/m0/s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
CYCLOPROPANECARBOXYLIC ACID, 1-((2-AMINO-3-CARBOXY-1-OXOPROPYL)AMINO)-, 1-(2-METHYLPROPYL) ESTER, (S)-
Preferred Name English
ISOBUTYL N-(L-ASPARTYL)-1-AMINOCYCLOPROPANECARBOXYLATE
Systematic Name English
CYCLOPROPANECARBOXYLIC ACID, 1-((2-AMINO-3-CARBOXY-1-OXOPROPYL)AMINO)-, ISOBUTYL ESTER, (S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
13943444
Created by admin on Tue Apr 01 22:57:07 GMT 2025 , Edited by admin on Tue Apr 01 22:57:07 GMT 2025
PRIMARY
CAS
104544-11-8
Created by admin on Tue Apr 01 22:57:07 GMT 2025 , Edited by admin on Tue Apr 01 22:57:07 GMT 2025
PRIMARY
FDA UNII
BCD4X2DUS2
Created by admin on Tue Apr 01 22:57:07 GMT 2025 , Edited by admin on Tue Apr 01 22:57:07 GMT 2025
PRIMARY
NIH
NCATS
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