Summary

IMPPAT Phytochemical identifier: IMPHY010014

Phytochemical name: 5-Pentyltetrahydrofuran-2-ol

Synonymous chemical names:
2-hydroxy-5-pentyltetrahydrofuran

External chemical identifiers:
CID:10702081, SureChEMBL:SCHEMBL6423756

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Chemical structure information

SMILES:
CCCCCC1CCC(O1)O

InChI:
InChI=1S/C9H18O2/c1-2-3-4-5-8-6-7-9(10)11-8/h8-10H,2-7H2,1H3

InChIKey:
FAPYUVKMJWJMEH-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCO5)O

Functional groups:
COC(C)O

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CCOC1

Scaffold Graph/Node level:
C1CCOC1

Scaffold Graph level:
C1CCCC1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Oxolanes

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Hydrocarbons

NP-Likeness score: 1.85

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Chemical structure download