CHEBI:183210 - 1-(O-alpha-D-mannopyranosyl)-29-keto-(3R,31R)-dotriacontanediol

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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 1-(O-alpha-D-mannopyranosyl)-29-keto-(3R,31R)-dotriacontanediol
ChEBI ID CHEBI:183210
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C38H74O9
Net Charge 0
Average Mass 675.001
Monoisotopic Mass 674.53328
InChI InChI=1S/C38H74O9/c1-31(40)29-33(42)26-24-22-20-18-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-19-21-23-25-32(41)27-28-46-38-37(45)36(44)35(43)34(30-39)47-38/h31-32,34-41,43-45H,2-30H2,1H3/t31-,32-,34?,35-,36?,37-,38+/m1/s1
InChIKey JDZCCUPQBXSRFJ-UMSNNPMJSA-N
SMILES O1C([C@@H](O)C(O)[C@@H](O)[C@H]1OCC[C@H](O)CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)C[C@H](O)C)CO
Metabolite of Species Details
Trypanosoma brucei (NCBI:txid5691) Found in cell culture (BTO:0000214). See: MetaboLights Study
ChEBI Ontology
Outgoing 1-(O-alpha-D-mannopyranosyl)-29-keto-(3R,31R)-dotriacontanediol (CHEBI:183210) is a O-acyl carbohydrate (CHEBI:52782)
IUPAC Name
(2R,30R)-2,30-dihydroxy-32-[(2S,3R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxydotriacontan-4-one
Manual Xrefs Databases
24822140 ChemSpider
LMFA13010031 LIPID MAPS
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