Summary

IMPPAT Phytochemical identifier: IMPHY009837

Phytochemical name: Longicamphenylone

Synonymous chemical names:
longicamphenylone

External chemical identifiers:
CID:91747202

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Chemical structure information

SMILES:
O=C1C2CCC3C1(C)CCCC(C23C)(C)C

InChI:
InChI=1S/C15H24O/c1-13(2)8-5-9-14(3)11-7-6-10(12(14)16)15(11,13)4/h10-11H,5-9H2,1-4H3

InChIKey:
VMYWIJUHQAMXNC-UHFFFAOYSA-N

DeepSMILES:
O=CCCCCC6C)CCCCC%107C))C)C

Functional groups:
CC(C)=O

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1C2CCC3C1CCCCC23

Scaffold Graph/Node level:
OC1C2CCC3C1CCCCC23

Scaffold Graph level:
CC1C2CCC3C1CCCCC23

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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-Likeness score: 2.268

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Chemical structure download