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

Details

Stereochemistry ABSOLUTE
Molecular Formula C29H30N2O8
Molecular Weight 534.5571
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(PHENYLMETHYL) N-(N-(((4-METHOXYPHENYL)METHOXY)CARBONYL)-L-.ALPHA.-ASPARTYL)-L-PHENYLALANATE

SMILES

COC1=CC=C(COC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)C=C1

InChI

InChIKey=HZIRKKLDMQBHQR-DQEYMECFSA-N
InChI=1S/C29H30N2O8/c1-37-23-14-12-22(13-15-23)19-39-29(36)31-24(17-26(32)33)27(34)30-25(16-20-8-4-2-5-9-20)28(35)38-18-21-10-6-3-7-11-21/h2-15,24-25H,16-19H2,1H3,(H,30,34)(H,31,36)(H,32,33)/t24-,25-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
1-(PHENYLMETHYL) N-(N-(((4-METHOXYPHENYL)METHOXY)CARBONYL)-L-ALPHA-ASPARTYL)-L-PHENYLALANATE
Preferred Name English
1-(PHENYLMETHYL) N-(N-(((4-METHOXYPHENYL)METHOXY)CARBONYL)-L-.ALPHA.-ASPARTYL)-L-PHENYLALANATE
Common Name English
L-PHENYLALANINE, N-(N-(((4-METHOXYPHENYL)METHOXY)CARBONYL)-L-.ALPHA.-ASPARTYL)-, 1-(PHENYLMETHYL) ESTER
Systematic Name English
Code System Code Type Description
PUBCHEM
119025995
Created by admin on Mon Mar 31 23:21:23 GMT 2025 , Edited by admin on Mon Mar 31 23:21:23 GMT 2025
PRIMARY
FDA UNII
RBA4DGT17A
Created by admin on Mon Mar 31 23:21:23 GMT 2025 , Edited by admin on Mon Mar 31 23:21:23 GMT 2025
PRIMARY
CAS
118203-05-7
Created by admin on Mon Mar 31 23:21:23 GMT 2025 , Edited by admin on Mon Mar 31 23:21:23 GMT 2025
PRIMARY