Summary

Molecular formula: C51H74O7
SMILES: OC/C(=C/CC/C(=C/CC/C(=C/Cc1cc(O)ccc1O)/C(=O)[C@H](C(CO)(O)C)CC[C@H]([C@H]1CC[C@@]2([C@]1(C)CC=C1C2=CC[C@@H]2[C@]1(C)CCC(=O)C2(C)C)C)C)/C)/C
InChI: InChI=1S/C51H74O7/c1-33(12-10-14-34(2)31-52)13-11-15-36(17-18-37-30-38(54)19-22-43(37)55)46(57)42(51(9,58)32-53)20-16-35(3)39-24-28-50(8)41-21-23-44-47(4,5)45(56)26-27-48(44,6)40(41)25-29-49(39,50)7/h13-14,17,19,21-22,25,30,35,39,42,44,52-55,58H,10-12,15-16,18,20,23-24,26-29,31-32H2,1-9H3/b33-13+,34-14+,36-17-/t35-,39-,42-,44+,48-,49-,50+,51?/m1/s1
InChIKey: WEKINJDEUOHVPL-ZCUZGZDUSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C(C=CCc1ccccc1)CCCCC1CCC2C3=CCC4CC(=O)CCC4C3=CCC12

Scaffold Graph/Node level:
OC(CCCCC1CCC2C1CCC1C3CCC(O)CC3CCC21)CCCC1CCCCC1

Scaffold Graph level:
CC(CCCCC1CCC2C1CCC1C3CCC(C)CC3CCC21)CCCC1CCCCC1

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Chemical classification

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

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Synonymous chemical names:
ganosinensin c

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External chemical identifiers:
CID_101476517; NPATLAS_NPA001174; CHEMSPIDER_78443883

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Chemical structure download