Summary

IMPPAT Phytochemical identifier: IMPHY008653

Phytochemical name: (8)-Gingerdione

Synonymous chemical names:
8-gingerdione, gingerdione,8-

External chemical identifiers:
CID:14440537, ChEBI:175095, FDASRS:70E1Y63Q2L

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Chemical structure information

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

InChI:
InChI=1S/C19H28O4/c1-3-4-5-6-7-8-16(20)14-17(21)11-9-15-10-12-18(22)19(13-15)23-2/h10,12-13,22H,3-9,11,14H2,1-2H3

InChIKey:
QDSRAFNZQKMHPZ-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCC=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: 1.102

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Chemical structure download