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Details

Stereochemistry EPIMERIC
Molecular Formula C21H24N8O5.2H2O
Molecular Weight 504.4964
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of A-DENOPTERIN DIHYDRATE

SMILES

O.O.CC(N(C)C1=CC=C(C=C1)C(=O)N[C@@H](CCC(O)=O)C(O)=O)C2=CN=C3N=C(N)N=C(N)C3=N2

InChI

InChIKey=OVSAHNHYPVHZGQ-JQRWPJOOSA-N
InChI=1S/C21H24N8O5.2H2O/c1-10(14-9-24-18-16(25-14)17(22)27-21(23)28-18)29(2)12-5-3-11(4-6-12)19(32)26-13(20(33)34)7-8-15(30)31;;/h3-6,9-10,13H,7-8H2,1-2H3,(H,26,32)(H,30,31)(H,33,34)(H4,22,23,24,27,28);2*1H2/t10?,13-;;/m0../s1

HIDE SMILES / InChI

Approval Year

Name Type Language
A-DENOPTERIN DIHYDRATE
MI  
Common Name English
GLUTAMIC ACID, N-(P-((1-(2,4-DIAMINO-6-PTERIDINYL)ETHYL)METHYLAMINO)BENZOYL)-, DIHYDRATE, L-
Systematic Name English
A-DENOPTERIN DIHYDRATE [MI]
Common Name English
Code System Code Type Description
MERCK INDEX
m544
Created by admin on Sat Dec 16 09:32:18 GMT 2023 , Edited by admin on Sat Dec 16 09:32:18 GMT 2023
PRIMARY Merck Index
PUBCHEM
91667954
Created by admin on Sat Dec 16 09:32:18 GMT 2023 , Edited by admin on Sat Dec 16 09:32:18 GMT 2023
PRIMARY
FDA UNII
2UQT19E1VZ
Created by admin on Sat Dec 16 09:32:18 GMT 2023 , Edited by admin on Sat Dec 16 09:32:18 GMT 2023
PRIMARY
CAS
25442-98-2
Created by admin on Sat Dec 16 09:32:18 GMT 2023 , Edited by admin on Sat Dec 16 09:32:18 GMT 2023
PRIMARY