Summary

Molecular formula: C21H28O5
SMILES: C/C(=CCCC(C(=O)O)CC(=O)c1cc(O)ccc1O)/CCC=C(C)C
InChI: InChI=1S/C21H28O5/c1-14(2)6-4-7-15(3)8-5-9-16(21(25)26)12-20(24)18-13-17(22)10-11-19(18)23/h6,8,10-11,13,16,22-23H,4-5,7,9,12H2,1-3H3,(H,25,26)/b15-8+
InChIKey: PNXHXPQJFNVWQM-OVCLIPMQSA-N

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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

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

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Synonymous chemical names:
fornicin c

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External chemical identifiers:
CID_16086602; NPATLAS_NPA018052; CHEMSPIDER_17245248

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Chemical structure download