Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:07 UTC
Update Date2025-03-25 00:51:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02185584
Frequency0.5
Structure
Chemical FormulaC15H15N5O4
Molecular Mass329.1124
SMILESNc1ncnc2c1ncn2C1Cc2cc(O)c(O)cc2C(CO)O1
InChI KeyZMQLMRQNSPXJHC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 2-benzopyrans
Direct Parent 2-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • n-substituted imidazoles
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • primary amines
  • purines and purine derivatives
  • pyrimidines and pyrimidine derivatives
  • Substituents
  • 1-hydroxy-2-unsubstituted benzenoid
  • imidazopyrimidine
  • pyrimidine
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • imidolactam
  • azole
  • n-substituted imidazole
  • alcohol
  • azacycle
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • 2-benzopyran
  • hydrocarbon derivative
  • benzenoid
  • primary amine
  • purine
  • organic nitrogen compound
  • amine
  • organooxygen compound