CHEBI:173810 - 1,4,5-Naphthalenetriol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 1,4,5-Naphthalenetriol
ChEBI ID CHEBI:173810
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H8O3
Net Charge 0
Average Mass 176.171
Monoisotopic Mass 176.04734
InChI InChI=1S/C10H8O3/c11-7-4-5-9(13)10-6(7)2-1-3-8(10)12/h1-5,11-13H
InChIKey NHEVNUARLCWEED-UHFFFAOYSA-N
SMILES OC1=C2C(=C(O)C=C1)C=CC=C2O
ChEBI Ontology
Outgoing 1,4,5-Naphthalenetriol (CHEBI:173810) is a naphthols (CHEBI:25392)
IUPAC Name
naphthalene-1,4,5-triol
Manual Xrefs Databases
2340766 ChemSpider
HMDB0032883 HMDB
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Registry Number Type Source
481-40-3 CAS Registry Number ChemIDplus