Summary

Molecular formula: C33H46O6
SMILES: COC(=O)C(=CCC[C@H]([C@H]1[C@@H](OC(=O)C)C[C@@]2([C@]1(C)CC(=O)C1=C2CC[C@@H]2[C@]1(C)C=CC(=O)C2(C)C)C)C)C
InChI: InChI=1S/C33H46O6/c1-19(11-10-12-20(2)29(37)38-9)27-24(39-21(3)34)18-32(7)22-13-14-25-30(4,5)26(36)15-16-31(25,6)28(22)23(35)17-33(27,32)8/h12,15-16,19,24-25,27H,10-11,13-14,17-18H2,1-9H3/t19-,24+,25+,27+,31+,32+,33-/m1/s1
InChIKey: QIBKWBBUQXWZDO-YOOSDHQBSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1C=CC2C3=C(CCC2C1)C1CCCC1CC3=O

Scaffold Graph/Node level:
OC1CCC2C(CCC3C4CCCC4CC(O)C23)C1

Scaffold Graph level:
CC1CCC2C(CCC3C4CCCC4CC(C)C23)C1

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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:
lepiotaprocerin j

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Chemical structure download