Summary

Molecular formula: C22H28O5
SMILES: COC1(OC(=O)C(=C1)CC/C=C(/CCC=C(C)C)C)c1cc(O)ccc1O
InChI: InChI=1S/C22H28O5/c1-15(2)7-5-8-16(3)9-6-10-17-14-22(26-4,27-21(17)25)19-13-18(23)11-12-20(19)24/h7,9,11-14,23-24H,5-6,8,10H2,1-4H3/b16-9+
InChIKey: FCRKCTMVNYZRSA-CXUHLZMHSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1C=CC(c2ccccc2)O1

Scaffold Graph/Node level:
OC1CCC(C2CCCCC2)O1

Scaffold Graph level:
CC1CCC(C2CCCCC2)C1

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Chemical classification

Kingdom: Organic compounds
Super class: Lipids and lipid-like molecules
Class: Prenol lipids
Sub class: Terpene lactones

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Synonymous chemical names:
fornicin b

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External chemical identifiers:
CID_16086600; NPATLAS_NPA013669; CHEMSPIDER_17245246

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Chemical structure download