Description
Tetrahymanone is isolated from Bradyrhizobium japonicum.
Synonyms
Gammaceran-3-one; (6aR,14bR)-4,4,6a,6b,9,9,12a,14b-Octamethyl-icosahydro-picen-3-one
IUPAC Name
(4aR,6aR,6aR,6bR,8aS,12aS,14aR,14bR)-4,4,6a,6b,9,9,12a,14b-octamethyl-2,4a,5,6,6a,7,8,8a,10,11,12,13,14,14a-tetradecahydro-1H-picen-3-one
Molecular Formula
C30H50O
Canonical SMILES
CC1(CCCC2(C1CCC3(C2CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C)C)C
InChI
InChI=1S/C30H50O/c1-25(2)15-9-16-27(5)20(25)12-18-29(7)22(27)10-11-23-28(6)17-14-24(31)26(3,4)21(28)13-19-30(23,29)8/h20-23H,9-19H2,1-8H3/t20-,21-,22+,23+,27-,28-,29+,30+/m0/s1
InChIKey
IMOCDWIUBNNKCU-KYSSMBTOSA-N
Boiling Point
477.2±13.0°C at 760 mmHg
Solubility
Soluble in Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone