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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H25N9O3
Molecular Weight 355.3961
Optical Activity ( - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TAN-1057A

SMILES

CN([C@H]1CNC(NC(N)=O)=NC1=O)C(=O)C[C@@H](N)CCCNC(N)=N

InChI

InChIKey=ZMWBCGMRXBPXEU-YUMQZZPRSA-N
InChI=1S/C13H25N9O3/c1-22(8-6-19-13(20-10(8)24)21-12(17)25)9(23)5-7(14)3-2-4-18-11(15)16/h7-8H,2-6,14H2,1H3,(H4,15,16,18)(H4,17,19,20,21,24,25)/t7-,8-/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H25N9O3
Molecular Weight 355.3961
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 17:41:11 GMT 2023
Edited
by admin
on Sat Dec 16 17:41:11 GMT 2023
Record UNII
74EKN36H9V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TAN-1057A
Code English
(3S)-3-AMINO-N-((5S)-2-((AMINOCARBONYL)AMINO)-1,4,5,6-TETRAHYDRO-6-OXO-5-PYRIMIDINYL)-6-((AMINOIMINOMETHYL)AMINO)-N-METHYLHEXANAMIDE
Systematic Name English
HEXANAMIDE, 3-AMINO-N-(2-((AMINOCARBONYL)AMINO)-1,4,5,6-TETRAHYDRO-4-OXO-5-PYRIMIDINYL)-6-((AMINOIMINOMETHYL)AMINO)-N-METHYL-, (S-(R*,R*))-
Systematic Name English
HEXANAMIDE, 3-AMINO-N-((5S)-2-((AMINOCARBONYL)AMINO)-1,4,5,6-TETRAHYDRO-6-OXO-5-PYRIMIDINYL)-6-((AMINOIMINOMETHYL)AMINO)-N-METHYL-, (3S)-
Systematic Name English
HEXANAMIDE, 3-AMINO-N-((5S)-2-((AMINOCARBONYL)AMINO)-1,4,5,6-TETRAHYDRO-4-OXO-5-PYRIMIDINYL)-6-((AMINOIMINOMETHYL)AMINO)-N-METHYL-, (3S)-
Systematic Name English
Code System Code Type Description
CAS
128126-44-3
Created by admin on Sat Dec 16 17:41:11 GMT 2023 , Edited by admin on Sat Dec 16 17:41:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID20926076
Created by admin on Sat Dec 16 17:41:11 GMT 2023 , Edited by admin on Sat Dec 16 17:41:11 GMT 2023
PRIMARY
PUBCHEM
3035519
Created by admin on Sat Dec 16 17:41:11 GMT 2023 , Edited by admin on Sat Dec 16 17:41:11 GMT 2023
PRIMARY
WIKIPEDIA
TAN-1057 A
Created by admin on Sat Dec 16 17:41:11 GMT 2023 , Edited by admin on Sat Dec 16 17:41:11 GMT 2023
PRIMARY
FDA UNII
74EKN36H9V
Created by admin on Sat Dec 16 17:41:11 GMT 2023 , Edited by admin on Sat Dec 16 17:41:11 GMT 2023
PRIMARY