Summary

Molecular formula: C23H36O8
SMILES: COC(=O)[C@@H]([C@@H](C(=O)OC)CC(=O)O)OC[C@H]1C(=C)CC[C@@H]2[C@]1(C)CCC[C@@]2(C)CO
InChI: InChI=1S/C23H36O8/c1-14-7-8-17-22(2,13-24)9-6-10-23(17,3)16(14)12-31-19(21(28)30-5)15(11-18(25)26)20(27)29-4/h15-17,19,24H,1,6-13H2,2-5H3,(H,25,26)/t15-,16-,17-,19+,22-,23+/m0/s1
InChIKey: FCYLLGSBJNTSAP-DZYDHYRWSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C=C1CCC2CCCCC2C1

Scaffold Graph/Node level:
CC1CCC2CCCCC2C1

Scaffold Graph level:
CC1CCC2CCCCC2C1

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Chemical classification

Kingdom: Organic compounds
Super class: Organic acids and derivatives
Class: Carboxylic acids and derivatives
Sub class: Tricarboxylic acids and derivatives

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Synonymous chemical names:
cryptoporic acid b

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External chemical identifiers:
CID_9889454; NPATLAS_NPA012143; CHEMSPIDER_8065125; ZINC_ZINC000034012776

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Chemical structure download