Summary

Molecular formula: C38H46O6
SMILES: COC(=O)[C@@]12CC[C@H]([C@]3(C2)c2c(O1)ccc(c2c1c(O3)c(C/C=C(/CC/C=C(/CCC=C(C)C)C)C)cc(c1)O)O)C(=C)C
InChI: InChI=1S/C38H46O6/c1-23(2)10-8-11-25(5)12-9-13-26(6)14-15-27-20-28(39)21-29-33-31(40)16-17-32-34(33)38(44-35(27)29)22-37(43-32,36(41)42-7)19-18-30(38)24(3)4/h10,12,14,16-17,20-21,30,39-40H,3,8-9,11,13,15,18-19,22H2,1-2,4-7H3/b25-12+,26-14+/t30-,37-,38+/m0/s1
InChIKey: CJGJKNWCOPSVLD-AQZWAIHVSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccc2c(c1)OC13CCCC(C1)Oc1cccc-2c13

Scaffold Graph/Node level:
C1CCC2C(C1)OC13CCCC(C1)OC1CCCC2C13

Scaffold Graph level:
C1CCC2C(C1)CC13CCCC(CC4CCCC2C41)C3

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Chemical classification

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

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Synonymous chemical names:
cochlearoid c

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External chemical identifiers:
NPATLAS_NPA019220; CHEMSPIDER_78441517

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Chemical structure download