Summary

IMPPAT Phytochemical identifier: IMPHY014949

Phytochemical name: Isointermedeol

Synonymous chemical names:
(-)-neointermedeol, isointermedeol

External chemical identifiers:
CID:527217

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Chemical structure information

SMILES:
CC(=C)C1CCC2(C(C1)C(C)(O)CCC2)C

InChI:
InChI=1S/C15H26O/c1-11(2)12-6-9-14(3)7-5-8-15(4,16)13(14)10-12/h12-13,16H,1,5-10H2,2-4H3

InChIKey:
DPQYOKVMVCQHMY-UHFFFAOYSA-N

DeepSMILES:
CC=C)CCCCCC6)CC)O)CCC6)))))C

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

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CCC2CCCCC2C1

Scaffold Graph/Node level:
C1CCC2CCCCC2C1

Scaffold Graph level:
C1CCC2CCCCC2C1

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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: Eudesmane sesquiterpenoids

NP-Likeness score: 2.993

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Chemical structure download