Summary

IMPPAT Phytochemical identifier: IMPHY016522

Phytochemical name: Avocadynofuran

Synonymous chemical names:
avocadynofuran

External chemical identifiers:
CID:6857797, ChEMBL:CHEMBL1453347, SureChEMBL:SCHEMBL8158965

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Chemical structure information

SMILES:
C#CCCCCCCCCCCCc1ccco1

InChI:
InChI=1S/C17H26O/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-15-13-16-18-17/h1,13,15-16H,3-12,14H2

InChIKey:
ONYOTXAYIZRIPJ-UHFFFAOYSA-N

DeepSMILES:
C#CCCCCCCCCCCCcccco5

Functional groups:
C#CC, coc

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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: Heteroaromatic compounds

NP-Likeness score: -0.137

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Chemical structure download