Summary

IMPPAT Phytochemical identifier: IMPHY007031

Phytochemical name: (-)-Pacifigorgiol

Synonymous chemical names:
(-)-pacifigorgiol

External chemical identifiers:
CID:73828281

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Chemical structure information

SMILES:
CC(=CC1C(C)CCC2C1(O)CCC2C)C

InChI:
InChI=1S/C15H26O/c1-10(2)9-14-11(3)5-6-13-12(4)7-8-15(13,14)16/h9,11-14,16H,5-8H2,1-4H3

InChIKey:
QGALFKRHZSPTEG-UHFFFAOYSA-N

DeepSMILES:
CC=CCCC)CCCC6O)CCC5C)))))))))))C

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

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CCC2CCCC2C1

Scaffold Graph/Node level:
C1CCC2CCCC2C1

Scaffold Graph level:
C1CCC2CCCC2C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Prenol lipids

ClassyFire Subclass: Monoterpenoids

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Sesquiterpenoids

NP Classifier Class: Pacifigorgiane sesquiterpenoids

NP-Likeness score: 2.417

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Chemical structure download