Summary

Molecular formula: C21H28O2
SMILES: CC(=O)[C@@]12CCCC([C@@H]2CC(=O)c2c1ccc(c2)C(C)C)(C)C
InChI: InChI=1S/C21H28O2/c1-13(2)15-7-8-17-16(11-15)18(23)12-19-20(4,5)9-6-10-21(17,19)14(3)22/h7-8,11,13,19H,6,9-10,12H2,1-5H3/t19-,21-/m0/s1
InChIKey: RTVFQOBGBPANTH-FPOVZHCZSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1CC2CCCCC2c2ccccc21

Scaffold Graph/Node level:
OC1CC2CCCCC2C2CCCCC12

Scaffold Graph level:
CC1CC2CCCCC2C2CCCCC12

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Chemical classification

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

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Synonymous chemical names:
inonotusic acid

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External chemical identifiers:
CID_139586026; NPATLAS_NPA010577; CHEMSPIDER_78441136; ZINC_ZINC000238776507

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Chemical structure download