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

Details

Stereochemistry RACEMIC
Molecular Formula C15H19Cl2N3O2
Molecular Weight 344.236
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRYPTOPHAN MUSTARD, DL-

SMILES

NC(CC1=CNC2=CC=C(C=C12)N(CCCl)CCCl)C(O)=O

InChI

InChIKey=DGRNTPAKIUYGJI-UHFFFAOYSA-N
InChI=1S/C15H19Cl2N3O2/c16-3-5-20(6-4-17)11-1-2-14-12(8-11)10(9-19-14)7-13(18)15(21)22/h1-2,8-9,13,19H,3-7,18H2,(H,21,22)

HIDE SMILES / InChI

Molecular Formula C15H19Cl2N3O2
Molecular Weight 344.236
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:26:43 GMT 2023
Edited
by admin
on Fri Dec 15 15:26:43 GMT 2023
Record UNII
IV1K341O5Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRYPTOPHAN MUSTARD, DL-
Common Name English
TRYPTOPHAN, 5-(BIS(2-CHLOROETHYL)AMINO)-
Systematic Name English
TRYPTOPHAN MUSTARD
Common Name English
NSC-62403
Code English
5-(BIS(2-CHLOROETHYL)AMINO)-DL-TRYPTOPHAN
Systematic Name English
Code System Code Type Description
FDA UNII
IV1K341O5Z
Created by admin on Fri Dec 15 15:26:43 GMT 2023 , Edited by admin on Fri Dec 15 15:26:43 GMT 2023
PRIMARY
NSC
62403
Created by admin on Fri Dec 15 15:26:43 GMT 2023 , Edited by admin on Fri Dec 15 15:26:43 GMT 2023
PRIMARY
CAS
153-88-8
Created by admin on Fri Dec 15 15:26:43 GMT 2023 , Edited by admin on Fri Dec 15 15:26:43 GMT 2023
PRIMARY
PUBCHEM
9059
Created by admin on Fri Dec 15 15:26:43 GMT 2023 , Edited by admin on Fri Dec 15 15:26:43 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE