Garcinone C
Properties
- Molecular formula
- C23H26O7
- Molar mass
- 414.45 g/mol
- Exact mass
- 414.1679 Da
- Melting point
- 216–218 °C
- logP
- 3.98Crippen estimate
- Polar surface area
- 131.4 Ų
- H-bond donors / acceptors
- 5 / 7
- Rotatable bonds
- 5
Identifiers
CAS number
76996-27-5SMILES
CC(C)=CCc1c(O)cc2oc3cc(O)c(O)c(CCC(C)(C)O)c3c(=O)c2c1OInChIKey
HLOCLVMUASBDDP-UHFFFAOYSA-NInChI
InChI=1S/C23H26O7/c1-11(2)5-6-12-14(24)9-17-19(21(12)27)22(28)18-13(7-8-23(3,4)29)20(26)15(25)10-16(18)30-17/h5,9-10,24-27,29H,6-8H2,1-4H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- 9H-Xanthen-9-one, 1,3,6,7-tetrahydroxy-8-(3-hydroxy-3-methylbutyl)-2-(3-methyl-2-buten-1-yl)-
- 9H-Xanthen-9-one, 1,3,6,7-tetrahydroxy-8-(3-hydroxy-3-methylbutyl)-2-(3-methyl-2-butenyl)-
- 1,3,6,7-Tetrahydroxy-8-(3-hydroxy-3-methylbutyl)-2-(3-methyl-2-buten-1-yl)-9H-xanthen-9-one
- 1,3,6,7-Tetrahydroxy-8-(3-hydroxy-3-methylbutyl)-2-(3-methylbut-2-enyl)xanthen-9-one
Work with Garcinone C
Similar compounds
γ-Mangostin31271-07-576 % similar
Mangostin6147-11-163 % similar
β-Mangostin20931-37-755 % similar
Gartanin33390-42-048 % similar
8-Deoxygartanin33390-41-941 % similar
Icaritin118525-40-939 % similar
Glycyrol23013-84-537 % similar
Demethylsuberosin21422-04-835 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds