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CHEBI:182914 - 2,3,14,20,22,25-Hexahydroxycholest-7-en-6-one

ChEBI IDCHEBI:182914
ChEBI Name2,3,14,20,22,25-Hexahydroxycholest-7-en-6-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H44O7
Net Charge0
Average Mass480.642
Monoisotopic Mass480.30870
SMILESCC(C)(O)CCC(O)C(C)(O)C1CCC2(O)C3=CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C
InChIInChI=1S/C27H44O7/c1-23(2,32)9-8-22(31)26(5,33)21-7-11-27(34)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h12,15,17,19-22,29-34H,6-11,13-14H2,1-5H3
InChIKeyNKDFYOWSKOHCCO-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2,3,14,20,22,25-Hexahydroxycholest-7-en-6-one (CHEBI:182914) is a steroid (CHEBI:35341)
IUPAC Name 
2,3,14-trihydroxy-10,13-dimethyl-17-(2,3,6-trihydroxy-6-methylheptan-2-yl)-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one
Manual XrefsDatabases
HMDB0030180HMDB
238902ChemSpider