Summary

Molecular formula: C32H46O8
SMILES: COC(=O)CC[C@@]1(C)[C@@H](C[C@@H]([C@@]23[C@@H]1C(=O)C[C@]1([C@@]3(C)CC[C@]31O[C@@]1(O[C@@]3(C)CC1)CC)CO2)OC(=O)C)C(=C)C
InChI: InChI=1S/C32H46O8/c1-9-30-14-13-28(7,39-30)31(40-30)15-12-27(6)29(31)17-22(34)25-26(5,11-10-24(35)36-8)21(19(2)3)16-23(38-20(4)33)32(25,27)37-18-29/h21,23,25H,2,9-18H2,1,3-8H3/t21-,23-,25+,26-,27+,28-,29+,30-,31-,32-/m0/s1
InChIKey: ZDSCEDBLFYKSDB-JXYXQROOSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1CC23COC4(CCCCC14)C2CCC31OC2CCC1O2

Scaffold Graph/Node level:
OC1CC23COC4(CCCCC14)C2CCC31OC2CCC1O2

Scaffold Graph level:
CC1CC23CCC4(CCCCC14)C2CCC31CC2CCC1C2

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Chemical classification

Kingdom: Organic compounds
Super class: Lipids and lipid-like molecules
Class: Fatty Acyls
Sub class: Eicosanoids

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Synonymous chemical names:
ganoboninketal c

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External chemical identifiers:
CID_118711498; NPATLAS_NPA001156; CHEMSPIDER_58112462; ZINC_ZINC000299836364

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Chemical structure download