CHEBI:61649 - cholesteryl 6-O-decanoyl-β-D-galactoside

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ChEBI Name cholesteryl 6-O-decanoyl-β-D-galactoside
ChEBI ID CHEBI:61649
ChEBI ASCII Name cholesteryl 6-O-decanoyl-beta-D-galactoside
Definition A cholesteryl 6-O-acyl-β-D-galactoside having decanoyl as the 6-O-acyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C43H74O7
Net Charge 0
Average Mass 703.04350
Monoisotopic Mass 702.54345
InChI InChI=1S/C43H74O7/c1-7-8-9-10-11-12-13-17-37(44)48-27-36-38(45)39(46)40(47)41(50-36)49-31-22-24-42(5)30(26-31)18-19-32-34-21-20-33(29(4)16-14-15-28(2)3)43(34,6)25-23-35(32)42/h18,28-29,31-36,38-41,45-47H,7-17,19-27H2,1-6H3/t29-,31+,32+,33-,34+,35+,36-,38+,39+,40-,41-,42+,43-/m1/s1
InChIKey FOCCPGVCDPXOQU-DIDMLHEZSA-N
SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)O[C@@H]1O[C@H](COC(=O)CCCCCCCCC)[C@H](O)[C@H](O)[C@H]1O)[C@H](C)CCCC(C)C
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via saponin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing cholesteryl 6-O-decanoyl-β-D-galactoside (CHEBI:61649) is a cholesteryl 6-O-acyl-β-D-galactoside (CHEBI:61629)
cholesteryl 6-O-decanoyl-β-D-galactoside (CHEBI:61649) is a decanoate ester (CHEBI:87658)
IUPAC Name
cholest-5-en-3β-yl 6-O-decanoyl-β-D-galactopyranoside
Synonyms Sources
ACGal C10 ChEBI
cholest-5-en-3β-yl 6-O-decanoyl-β-D-galactoside ChEBI
cholesteryl 6-O-capryl-β-D-galactopyranoside ChEBI
cholesteryl 6-O-decanoyl-β-D-galactopyranoside ChEBI
Registry Number Type Source
20379966 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
20143357 PubMed citation Europe PMC
Last Modified
03 September 2015