Summary

IMPPAT Phytochemical identifier: IMPHY002715

Phytochemical name: [10]-Gingerdione

Synonymous chemical names:
10-gingerdione, [10]-gingerdione, gingerdione, (10)-

External chemical identifiers:
CID:14440539, ChEBI:175457

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Chemical structure information

SMILES:
CCCCCCCCCC(=O)CC(=O)CCc1ccc(c(c1)OC)O

InChI:
InChI=1S/C21H32O4/c1-3-4-5-6-7-8-9-10-18(22)16-19(23)13-11-17-12-14-20(24)21(15-17)25-2/h12,14-15,24H,3-11,13,16H2,1-2H3

InChIKey:
QPSYZJDGMPQMSV-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCC=O)CC=O)CCcccccc6)OC)))O

Functional groups:
CC(C)=O, cO, cOC

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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: Benzenoids

ClassyFire Class: Phenols

ClassyFire Subclass: Methoxyphenols

NP-Likeness score: 1.014

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Chemical structure download