EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:145146 - Luperoside K

ChEBI IDCHEBI:145146
ChEBI NameLuperoside K
Stars
Last Modified30 January 2020
Submittermwilliams
DownloadsMolfile
FormulaC70H110O36
Net Charge0
Average Mass1527.614
Monoisotopic Mass1526.67768
SMILES[H][C@]12CC=C3[C@]4([H])CC(C)(C)CC[C@]4(C(=O)O[C@@H]4O[C@H](C)[C@@H](O)[C@@H](O[C@@H]5O[C@@H](C)[C@@H](O)[C@@H](O)[C@H]5O)[C@@H]4O[C@H]4O[C@@H](C)[C@H](O[C@@H]5OC[C@@H](O)[C@@H](O)[C@H]5O)[C@H](O)[C@@H]4O)[C@@H](O)C[C@@]3(C)[C@@]1(C)CC[C@]1([H])[C@@]2(C)CC[C@@H](O[C@@H]2O[C@@H](C(=O)O)[C@H](O)[C@H](O[C@H]3OC[C@@H](O)[C@H](O)[C@@H]3O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@]1(C)C=O
InChIInChI=1S/C70H110O36/c1-24-36(76)41(81)46(86)59(95-24)102-51-37(77)25(2)96-62(54(51)104-60-48(88)43(83)50(26(3)97-60)100-57-44(84)38(78)29(73)21-93-57)106-64(92)70-17-16-65(4,5)18-28(70)27-10-11-33-66(6)14-13-35(67(7,23-72)32(66)12-15-68(33,8)69(27,9)19-34(70)75)99-63-55(105-61-47(87)42(82)40(80)31(20-71)98-61)52(49(89)53(103-63)56(90)91)101-58-45(85)39(79)30(74)22-94-58/h10,23-26,28-55,57-63,71,73-89H,11-22H2,1-9H3,(H,90,91)/t24-,25+,26-,28-,29+,30+,31+,32+,33+,34-,35+,36+,37+,38+,39-,40+,41+,42-,43+,44+,45-,46+,47+,48-,49+,50-,51+,52-,53+,54-,55+,57-,58+,59-,60+,61-,62-,63+,66+,67+,68-,69+,70+/m0/s1
InChIKeyCVTCXZFLADPFGM-MRHYJDKWSA-N
Species of MetaboliteComponentSourceComments
Momordica charantia (ncbitaxon:3673) seed (BTO:0001226) MetaboLights (MTBLS701)
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Luperoside K (CHEBI:145146) is a pentacyclic triterpenoid (CHEBI:25872)
Luperoside K (CHEBI:145146) is a triterpenoid saponin (CHEBI:61778)
Manual XrefsDatabases
C00039666KNApSAcK