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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H19N2O7P
Molecular Weight 346.2729
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-((3-HYDROXY-2-METHYL-5-((PHOSPHONOOXY)METHYL)-4-PYRIDINYL)METHYLENE)-L-VALINE

SMILES

CC(C)[C@H](\N=C\C1=C(O)C(C)=NC=C1COP(O)(O)=O)C(O)=O

InChI

InChIKey=CZSZGIWVBXFKBW-QZSDQICDSA-N
InChI=1S/C13H19N2O7P/c1-7(2)11(13(17)18)15-5-10-9(6-22-23(19,20)21)4-14-8(3)12(10)16/h4-5,7,11,16H,6H2,1-3H3,(H,17,18)(H2,19,20,21)/b15-5+/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H19N2O7P
Molecular Weight 346.2729
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:37:10 GMT 2023
Edited
by admin
on Sat Dec 16 01:37:10 GMT 2023
Record UNII
8Y0QNU2JVT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-((3-HYDROXY-2-METHYL-5-((PHOSPHONOOXY)METHYL)-4-PYRIDINYL)METHYLENE)-L-VALINE
Systematic Name English
VALINE, N-((3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYL-4-PYRIDYL)METHYLENE)-, 5-(DIHYDROGEN PHOSPHATE), L-
Common Name English
L-VALINE, N-((3-HYDROXY-2-METHYL-5-((PHOSPHONOOXY)METHYL)-4-PYRIDINYL)METHYLENE)-
Systematic Name English
Code System Code Type Description
CAS
32653-39-7
Created by admin on Sat Dec 16 01:37:10 GMT 2023 , Edited by admin on Sat Dec 16 01:37:10 GMT 2023
PRIMARY
PUBCHEM
76957120
Created by admin on Sat Dec 16 01:37:10 GMT 2023 , Edited by admin on Sat Dec 16 01:37:10 GMT 2023
PRIMARY
FDA UNII
8Y0QNU2JVT
Created by admin on Sat Dec 16 01:37:10 GMT 2023 , Edited by admin on Sat Dec 16 01:37:10 GMT 2023
PRIMARY