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Details

Stereochemistry ACHIRAL
Molecular Formula C18H14N6O2
Molecular Weight 346.3428
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(2,4-DIAMINO-7-(4-HYDROXYPHENYL)PTERIDIN-6-YL)PHENOL

SMILES

NC1=NC2=C(N=C(C3=CC=C(O)C=C3)C(=N2)C4=CC=C(O)C=C4)C(N)=N1

InChI

InChIKey=OQWMHOAPOCKKHC-UHFFFAOYSA-N
InChI=1S/C18H14N6O2/c19-16-15-17(24-18(20)23-16)22-14(10-3-7-12(26)8-4-10)13(21-15)9-1-5-11(25)6-2-9/h1-8,25-26H,(H4,19,20,22,23,24)

HIDE SMILES / InChI

Molecular Formula C18H14N6O2
Molecular Weight 346.3428
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 Tue Apr 01 20:02:39 GMT 2025
Edited
by admin
on Tue Apr 01 20:02:39 GMT 2025
Record UNII
M7ZN3T2AAX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(2,4-DIAMINO-7-(4-HYDROXYPHENYL)PTERIDIN-6-YL)PHENOL
Systematic Name English
NSC-67634
Preferred Name English
PHENOL, 4,4'-(2,4-DIAMINO-6,7-PTERIDINEDIYL)BIS-
Systematic Name English
4-(2,4-DIAMINO-6-(4-HYDROXYPHENYL)-7-PTERIDINYL)PHENOL
Systematic Name English
PHENOL, 4-(2,4-DIAMINO-6-(4-HYDROXYPHENYL)-7-PTERIDINYL)-
Systematic Name English
PHENOL, 4,4'-(2,4-DIAMINO-6,7-PTERIDINEDIYL)DI-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID40989820
Created by admin on Tue Apr 01 20:02:39 GMT 2025 , Edited by admin on Tue Apr 01 20:02:39 GMT 2025
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NSC
67634
Created by admin on Tue Apr 01 20:02:39 GMT 2025 , Edited by admin on Tue Apr 01 20:02:39 GMT 2025
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FDA UNII
M7ZN3T2AAX
Created by admin on Tue Apr 01 20:02:39 GMT 2025 , Edited by admin on Tue Apr 01 20:02:39 GMT 2025
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PUBCHEM
249363
Created by admin on Tue Apr 01 20:02:39 GMT 2025 , Edited by admin on Tue Apr 01 20:02:39 GMT 2025
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CAS
6967-77-7
Created by admin on Tue Apr 01 20:02:39 GMT 2025 , Edited by admin on Tue Apr 01 20:02:39 GMT 2025
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