Summary

Molecular formula: C42H66O11
SMILES: COC(=O)CC(CC(=O)O[C@@H]1CC[C@]2([C@H](C1(C)C)CCC1=C2CC[C@]2([C@@]1(C)CC[C@@H]2[C@H](C(=O)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)CCC=C(C)C)C)C)(O)C
InChI: InChI=1S/C42H66O11/c1-24(2)11-10-12-25(36(48)53-37-35(47)34(46)29(43)23-51-37)26-15-19-42(8)28-13-14-30-38(3,4)31(52-33(45)22-39(5,49)21-32(44)50-9)17-18-40(30,6)27(28)16-20-41(26,42)7/h11,25-26,29-31,34-35,37,43,46-47,49H,10,12-23H2,1-9H3/t25-,26-,29-,30+,31-,34+,35-,37+,39?,40-,41-,42+/m1/s1
InChIKey: PIKUUXNDOMSKCQ-DFXGZFGXSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C(CC1CCC2C3=C(CCC12)C1CCCCC1CC3)OC1CCCCO1

Scaffold Graph/Node level:
OC(CC1CCC2C1CCC1C3CCCCC3CCC12)OC1CCCCO1

Scaffold Graph level:
CC(CC1CCCCC1)CC1CCC2C1CCC1C3CCCCC3CCC12

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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 h

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External chemical identifiers:
CID_11158482; NPATLAS_NPA012144; CHEMSPIDER_78437714

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Chemical structure download