Summary

IMPPAT Phytochemical identifier: IMPHY009848

Phytochemical name: Pogostol

Synonymous chemical names:
pogostol

External chemical identifiers:
CID:5320651, ChEBI:167356

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Chemical structure information

SMILES:
CC1CCC2C1CC(CCC2(C)O)C(=C)C

InChI:
InChI=1S/C15H26O/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)13(14)9-12/h11-14,16H,1,5-9H2,2-4H3

InChIKey:
VYOZKWKETGHHDW-UHFFFAOYSA-N

DeepSMILES:
CCCCCC5CCCCC7C)O))))C=C)C

Functional groups:
C=C(C)C, CO

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CCC2CCCC2CC1

Scaffold Graph/Node level:
C1CCC2CCCC2CC1

Scaffold Graph level:
C1CCC2CCCC2CC1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Prenol lipids

ClassyFire Subclass: Sesquiterpenoids

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Sesquiterpenoids

NP Classifier Class: Guaiane sesquiterpenoids

NP-Likeness score: 2.968

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Chemical structure download