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

Details

Stereochemistry ABSOLUTE
Molecular Formula C9H14N5O7P
Molecular Weight 335.2105
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7,8-DIHYDRONEOPTERIN MONOPHOSPHATE

SMILES

NC1=NC(=O)C2=C(NCC(=N2)[C@H](O)[C@H](O)COP(O)(O)=O)N1

InChI

InChIKey=PLSQMGZYOGSOCE-XINAWCOVSA-N
InChI=1S/C9H14N5O7P/c10-9-13-7-5(8(17)14-9)12-3(1-11-7)6(16)4(15)2-21-22(18,19)20/h4,6,15-16H,1-2H2,(H2,18,19,20)(H4,10,11,13,14,17)/t4-,6+/m1/s1

HIDE SMILES / InChI

Molecular Formula C9H14N5O7P
Molecular Weight 335.2105
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 15:18:47 GMT 2023
Edited
by admin
on Sat Dec 16 15:18:47 GMT 2023
Record UNII
3PV4FYX8X6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7,8-DIHYDRONEOPTERIN MONOPHOSPHATE
Systematic Name English
4(3H)-PTERIDINONE, 2-AMINO-6-((1S,2R)-1,2-DIHYDROXY-3-(PHOSPHONOOXY)PROPYL)-7,8-DIHYDRO-
Systematic Name English
4(1H)-Pteridinone, 2-amino-6-[1,2-dihydroxy-3-(phosphonooxy)propyl]-7,8-dihydro-, [S-(R*,S*)]-
Systematic Name English
2-Amino-6-[(1S,2R)-1,2-dihydroxy-3-(phosphonooxy)propyl]-7,8-dihydro-4(3H)-pteridinone
Systematic Name English
1,2,3-Propanetriol, 1-(2-amino-7,8-dihydro-4-hydroxy-6-pteridinyl)-, 3-(dihydrogen phosphate), D-erythro-
Common Name English
4(1H)-Pteridinone, 2-amino-6-[(1S,2R)-1,2-dihydroxy-3-(phosphonooxy)propyl]-7,8-dihydro-
Systematic Name English
Code System Code Type Description
FDA UNII
3PV4FYX8X6
Created by admin on Sat Dec 16 15:18:47 GMT 2023 , Edited by admin on Sat Dec 16 15:18:47 GMT 2023
PRIMARY
CAS
19622-42-5
Created by admin on Sat Dec 16 15:18:47 GMT 2023 , Edited by admin on Sat Dec 16 15:18:47 GMT 2023
PRIMARY
PUBCHEM
135398608
Created by admin on Sat Dec 16 15:18:47 GMT 2023 , Edited by admin on Sat Dec 16 15:18:47 GMT 2023
PRIMARY