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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H9N5O3
Molecular Weight 223.1888
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ASPEROPTERIN B

SMILES

CN1C(=O)C(CO)=NC2=C1N=C(N)NC2=O

InChI

InChIKey=JEEFWMUINIMFQO-UHFFFAOYSA-N
InChI=1S/C8H9N5O3/c1-13-5-4(6(15)12-8(9)11-5)10-3(2-14)7(13)16/h14H,2H2,1H3,(H3,9,11,12,15)

HIDE SMILES / InChI

Molecular Formula C8H9N5O3
Molecular Weight 223.1888
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 02:55:54 GMT 2023
Edited
by admin
on Sat Dec 16 02:55:54 GMT 2023
Record UNII
AH6NWT26CT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ASPEROPTERIN B
Common Name English
4,7(3H,8H)-PTERIDINEDIONE, 2-AMINO-6-(HYDROXYMETHYL)-8-METHYL-
Systematic Name English
2-AMINO-6-(HYDROXYMETHYL)-8-METHYL-1H-PTERIDINE-4,7-DIONE
Systematic Name English
2-AMINO-6-(HYDROXYMETHYL)-8-METHYL-4,7(3H,8H)-PTERIDINEDIONE
Systematic Name English
4,7(1H,8H)-PTERIDINEDIONE, 2-AMINO-6-(HYDROXYMETHYL)-8-METHYL-
Systematic Name English
ASPEROPTERIN-B
Common Name English
Code System Code Type Description
PUBCHEM
135566048
Created by admin on Sat Dec 16 02:55:54 GMT 2023 , Edited by admin on Sat Dec 16 02:55:54 GMT 2023
PRIMARY
CAS
20041-66-1
Created by admin on Sat Dec 16 02:55:54 GMT 2023 , Edited by admin on Sat Dec 16 02:55:54 GMT 2023
PRIMARY
FDA UNII
AH6NWT26CT
Created by admin on Sat Dec 16 02:55:54 GMT 2023 , Edited by admin on Sat Dec 16 02:55:54 GMT 2023
PRIMARY