Summary

IMPPAT Phytochemical identifier: IMPHY005691

Phytochemical name: o-Dihydroxyphenol

Synonymous chemical names:
o-dihydroxyphenol, o-dihydroxyphenols

External chemical identifiers:
CID:22644299, SureChEMBL:SCHEMBL497533

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Chemical structure information

SMILES:
OC1C=CC=CC1(O)O

InChI:
InChI=1S/C6H8O3/c7-5-3-1-2-4-6(5,8)9/h1-5,7-9H

InChIKey:
PUTCXBJUWNRWJH-UHFFFAOYSA-N

DeepSMILES:
OCC=CC=CC6O)O

Functional groups:
CO, OC1(O)C=CC=CC1

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=CCCC=C1

Scaffold Graph/Node level:
C1CCCCC1

Scaffold Graph level:
C1CCCCC1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Alcohols and polyols

NP Classifier Biosynthetic pathway: Shikimates and Phenylpropanoids

NP-Likeness score: 2.007

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Chemical structure download