Summary

IMPPAT Phytochemical identifier: IMPHY017919

Phytochemical name: Ar-dihydro-turmerone

Synonymous chemical names:
ar-dihydro-turmerone, dihydro-ar-turmerone

Chemical structure information

SMILES:
CC(CC(=O)C[C@@H](c1ccc(cc1)C)C)C

InChI:
InChI=1S/C15H22O/c1-11(2)9-15(16)10-13(4)14-7-5-12(3)6-8-14/h5-8,11,13H,9-10H2,1-4H3/t13-/m0/s1

InChIKey:
FWSUEHMNQCROMJ-ZDUSSCGKSA-N

DeepSMILES:
CCCC=O)C[C@@H]cccccc6))C)))))C)))))C

Functional groups:
CC(C)=O

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccccc1

Scaffold Graph/Node level:
C1CCCCC1

Scaffold Graph level:
C1CCCCC1

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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: Bisabolane sesquiterpenoids

NP-Likeness score: 0.277

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Chemical structure download