Summary

Molecular formula: C35H54O8
SMILES: O[C@H](C(=C)C)CC[C@H]([C@H]1CC[C@@]2([C@]1(C)CCC1=C2CC[C@@H]2[C@]1(C)CCC(=O)C2(C)C)C)C(=O)O[C@H]1[C@H](O)OC[C@H]([C@@H]1O)O
InChI: InChI=1S/C35H54O8/c1-19(2)24(36)10-8-20(30(40)43-29-28(39)25(37)18-42-31(29)41)21-12-16-35(7)23-9-11-26-32(3,4)27(38)14-15-33(26,5)22(23)13-17-34(21,35)6/h20-21,24-26,28-29,31,36-37,39,41H,1,8-18H2,2-7H3/t20-,21-,24+,25-,26+,28+,29-,31-,33-,34-,35+/m1/s1
InChIKey: MDOFKFYGVBTDAC-RSWXTIEXSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1CCC2C3=C(CCC2C1)C1CCC(CC(=O)OC2CCCOC2)C1CC3

Scaffold Graph/Node level:
OC1CCC2C(CCC3C2CCC2C(CC(O)OC4CCCOC4)CCC23)C1

Scaffold Graph level:
CC1CCC2C(CCC3C2CCC2C(CC(C)CC4CCCCC4)CCC23)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:
fomitoside b

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External chemical identifiers:
NPATLAS_NPA009470; CHEMSPIDER_78437375

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Chemical structure download