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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H29N5O3
Molecular Weight 375.4653
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIPEPTIDE DIAMINOBUTYROYL BENZYLAMIDE

SMILES

NCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CCN)C(=O)NCC2=CC=CC=C2

InChI

InChIKey=CTUFKZFWHRPQEC-HOTGVXAUSA-N
InChI=1S/C19H29N5O3/c20-10-8-15(18(26)22-13-14-5-2-1-3-6-14)23-19(27)16-7-4-12-24(16)17(25)9-11-21/h1-3,5-6,15-16H,4,7-13,20-21H2,(H,22,26)(H,23,27)/t15-,16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H29N5O3
Molecular Weight 375.4653
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 Fri Dec 15 21:39:41 GMT 2023
Edited
by admin
on Fri Dec 15 21:39:41 GMT 2023
Record UNII
O0FY926GMK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIPEPTIDE DIAMINOBUTYROYL BENZYLAMIDE
Common Name English
SYN-AKE FREE BASE
Common Name English
BUTANAMIDE, .BETA.-ALANYL-L-PROLYL-2,4-DIAMINO-N-(PHENYLMETHYL)-, (2S)-
Systematic Name English
Code System Code Type Description
CAS
823202-98-8
Created by admin on Fri Dec 15 21:39:41 GMT 2023 , Edited by admin on Fri Dec 15 21:39:41 GMT 2023
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FDA UNII
O0FY926GMK
Created by admin on Fri Dec 15 21:39:41 GMT 2023 , Edited by admin on Fri Dec 15 21:39:41 GMT 2023
PRIMARY
DAILYMED
O0FY926GMK
Created by admin on Fri Dec 15 21:39:41 GMT 2023 , Edited by admin on Fri Dec 15 21:39:41 GMT 2023
PRIMARY
PUBCHEM
59499763
Created by admin on Fri Dec 15 21:39:41 GMT 2023 , Edited by admin on Fri Dec 15 21:39:41 GMT 2023
PRIMARY
EPA CompTox
DTXSID80231698
Created by admin on Fri Dec 15 21:39:41 GMT 2023 , Edited by admin on Fri Dec 15 21:39:41 GMT 2023
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Related Record Type Details
SALT/SOLVATE -> PARENT