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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H22N2O7
Molecular Weight 414.4086
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(BENZYLOXYCARBONYL)ASPARTYLPHENYLALANINE

SMILES

OC(=O)C[C@H](NC(=O)OCC1=CC=CC=C1)C(=O)N[C@@H](CC2=CC=CC=C2)C(O)=O

InChI

InChIKey=LMNMQXZOEAWPJN-IRXDYDNUSA-N
InChI=1S/C21H22N2O7/c24-18(25)12-16(23-21(29)30-13-15-9-5-2-6-10-15)19(26)22-17(20(27)28)11-14-7-3-1-4-8-14/h1-10,16-17H,11-13H2,(H,22,26)(H,23,29)(H,24,25)(H,27,28)/t16-,17-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H22N2O7
Molecular Weight 414.4086
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:05:03 GMT 2023
Edited
by admin
on Sat Dec 16 13:05:03 GMT 2023
Record UNII
QE0107GXD2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(BENZYLOXYCARBONYL)ASPARTYLPHENYLALANINE
Systematic Name English
L-PHENYLALANINE, N-((PHENYLMETHOXY)CARBONYL)-L-.ALPHA.-ASPARTYL-
Systematic Name English
N-((PHENYLMETHOXY)CARBONYL)-L-.ALPHA.-ASPARTYL-L-PHENYLALANINE
Systematic Name English
N-(BENZYLOXYCARBONYL)-L-.ALPHA.-ASPARTYL-L-PHENYLALANINE
Systematic Name English
N-BENZYLOXYCARBONYL-ASPARTYLPHENYLALANINE
Systematic Name English
Code System Code Type Description
PUBCHEM
11090974
Created by admin on Sat Dec 16 13:05:03 GMT 2023 , Edited by admin on Sat Dec 16 13:05:03 GMT 2023
PRIMARY
FDA UNII
QE0107GXD2
Created by admin on Sat Dec 16 13:05:03 GMT 2023 , Edited by admin on Sat Dec 16 13:05:03 GMT 2023
PRIMARY
CAS
102068-14-4
Created by admin on Sat Dec 16 13:05:03 GMT 2023 , Edited by admin on Sat Dec 16 13:05:03 GMT 2023
PRIMARY