Summary

Molecular formula: C38H52O13
SMILES: CC(=O)O[C@@H]1C(=O)C2=C([C@]3([C@@]1(C)[C@H](CC3=O)[C@@H](CCC=C(C(=O)O)C)C)C)C(=O)C[C@@H]1[C@]2(C)CC[C@@H]([C@]1(C)COC(=O)C[C@](CC(=O)O)(O)C)O
InChI: InChI=1S/C38H52O13/c1-19(10-9-11-20(2)33(47)48)22-14-26(42)38(8)29-23(40)15-24-35(5,30(29)31(46)32(37(22,38)7)51-21(3)39)13-12-25(41)36(24,6)18-50-28(45)17-34(4,49)16-27(43)44/h11,19,22,24-25,32,41,49H,9-10,12-18H2,1-8H3,(H,43,44)(H,47,48)/t19-,22-,24-,25+,32-,34+,35+,36-,37+,38+/m1/s1
InChIKey: AUIMRAJEISHKMP-IIYFVGFCSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1CC2CCC(=O)C2C2=C1C1CCCCC1CC2=O

Scaffold Graph/Node level:
OC1CCC2CC(O)C3C4CCCCC4CC(O)C3C12

Scaffold Graph level:
CC1CCC2CC(C)C3C4CCCCC4CC(C)C3C12

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Chemical classification

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

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Synonymous chemical names:
ganoleucoin z

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Chemical structure download