CHEBI:166998 - tomatidine 3-O-β-D-glucopyranoside(1+)

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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 tomatidine 3-O-β-D-glucopyranoside(1+)
ChEBI ID CHEBI:166998
ChEBI ASCII Name tomatidine 3-O-beta-D-glucopyranoside(1+)
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C33H56NO7
Net Charge +1
Average Mass 578.810
Monoisotopic Mass 578.40513
InChI InChI=1S/C33H55NO7/c1-17-7-12-33(34-15-17)18(2)26-24(41-33)14-23-21-6-5-19-13-20(8-10-31(19,3)22(21)9-11-32(23,26)4)39-30-29(38)28(37)27(36)25(16-35)40-30/h17-30,34-38H,5-16H2,1-4H3/p+1/t17-,18-,19-,20-,21+,22-,23-,24-,25+,26-,27+,28-,29+,30+,31-,32-,33-/m0/s1
InChIKey JDRMNHOIHYWSFN-UGSFAPCESA-O
SMILES C1C[C@]2([C@@](CC[C@@]3([C@@]2(CC[C@@H](C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)C)[H])([C@]5([C@]1([C@@]6([C@](C5)(O[C@@]7([C@H]6C)[NH2+]C[C@@H](C)CC7)[H])[H])C)[H])[H])[H]
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 tomatidine 3-O-β-D-glucopyranoside(1+) (CHEBI:166998) has functional parent tomatidine (CHEBI:9629)
tomatidine 3-O-β-D-glucopyranoside(1+) (CHEBI:166998) is a monosaccharide derivative (CHEBI:63367)
tomatidine 3-O-β-D-glucopyranoside(1+) (CHEBI:166998) is a sterol 3-β-D-glucoside (CHEBI:37424)
Synonym Source
tomatidine 3-O-β-D-glucopyranoside UniProt
Citation Waiting for Citations Type Source
9076990 PubMed citation SUBMITTER