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

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2,3,14,20,22,25-Hexahydroxycholest-7-en-6-one
ChEBI ID CHEBI:182914
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C27H44O7
Net Charge 0
Average Mass 480.642
Monoisotopic Mass 480.30870
InChI InChI=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
InChIKey NKDFYOWSKOHCCO-UHFFFAOYSA-N
SMILES OC12C(C(CC1)C(O)(C(O)CCC(O)(C)C)C)(CCC3C4(C(CC(O)C(O)C4)C(=O)C=C23)C)C
ChEBI Ontology
Outgoing 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 Xrefs Databases
238902 ChemSpider
HMDB0030180 HMDB
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