Identification Common Name (2alpha,3alpha,5alpha,22R,23R)-2,3,22,23-Tetrahydroxy-25-methylergost-24(28)en-6-one Class Small Molecule Description (2beta,3beta,5alpha,22R,23R)-2,3,22,23-Tetrahydroxy-25-methylergost-24(28)en-6-one is found in common bean. (2beta,3beta,5alpha,22R,23R)-2,3,22,23-Tetrahydroxy-25-methylergost-24(28)en-6-one is a constituent of the immature seeds of Phaseolus vulgaris (kidney bean). Contaminant Sources Contaminant Type Not Available Chemical Structure Synonyms Value Source (2a,3a,5a,22R,23R)-2,3,22,23-Tetrahydroxy-25-methylergost-24(28)en-6-one Generator (2Α,3α,5α,22R,23R)-2,3,22,23-tetrahydroxy-25-methylergost-24(28)en-6-one Generator 25-Methyldiolichosterone HMDB 25-Methyldolichosterone HMDB
Chemical Formula C29 H48 O5 Average Molecular Mass 476.688 g/mol Monoisotopic Mass 476.350 g/mol CAS Registry Number 111618-87-2 IUPAC Name 14-(3,4-dihydroxy-6,6-dimethyl-5-methylideneheptan-2-yl)-4,5-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-8-one Traditional Name 14-(3,4-dihydroxy-6,6-dimethyl-5-methylideneheptan-2-yl)-4,5-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-8-one SMILES CC(C(O)C(O)C(=C)C(C)(C)C)C1CCC2C3CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C InChI Identifier InChI=1S/C29H48O5/c1-15(25(33)26(34)16(2)27(3,4)5)18-8-9-19-17-12-22(30)21-13-23(31)24(32)14-29(21,7)20(17)10-11-28(18,19)6/h15,17-21,23-26,31-34H,2,8-14H2,1,3-7H3 InChI Key HAOQPQZVDMAOKT-UHFFFAOYSA-N Chemical Taxonomy Description belongs to the class of organic compounds known as tetrahydroxy bile acids, alcohols and derivatives. These are prenol lipids structurally characterized by a bile acid or alcohol which bears four hydroxyl groups. Kingdom Organic compounds Super Class Lipids and lipid-like molecules Class Steroids and steroid derivatives Sub Class Bile acids, alcohols and derivatives Direct Parent Tetrahydroxy bile acids, alcohols and derivatives Alternative Parents Substituents Ergosterol-skeleton
Ergostane-skeleton
Tetrahydroxy bile acid, alcohol, or derivatives
Ecdysteroid
23-hydroxysteroid
22-hydroxysteroid
3-hydroxysteroid
2-hydroxysteroid
Hydroxysteroid
Oxosteroid
6-oxosteroid
Cyclic alcohol
Ketone
Secondary alcohol
Hydrocarbon derivative
Alcohol
Organic oxide
Organic oxygen compound
Organooxygen compound
Carbonyl group
Aliphatic homopolycyclic compound Molecular Framework Aliphatic homopolycyclic compounds External Descriptors Not Available 
