Summary

Molecular formula: C14H18O4
SMILES: OCCC1=C(C)C(=O)C2=C(C1=O)C[C@](C2)(C)CO
InChI: InChI=1S/C14H18O4/c1-8-9(3-4-15)13(18)11-6-14(2,7-16)5-10(11)12(8)17/h15-16H,3-7H2,1-2H3/t14-/m1/s1
InChIKey: ZJUSBIHJNNDXNV-CQSZACIVSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1C=CC(=O)C2=C1CCC2

Scaffold Graph/Node level:
OC1CCC(O)C2CCCC12

Scaffold Graph level:
CC1CCC(C)C2CCCC12

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Chemical classification

Kingdom: Organic compounds
Super class: Organic oxygen compounds
Class: Organooxygen compounds
Sub class: Carbonyl compounds

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Synonymous chemical names:
deliquinone

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External chemical identifiers:
CID_100927704; NPATLAS_NPA007147; CHEMSPIDER_78442018; ZINC_ZINC000085948208

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Chemical structure download