CHEBI:66439 - sciscllascilloside E-1

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ChEBI Name sciscllascilloside E-1
ChEBI ID CHEBI:66439
Definition A triterpenoid saponin isolated from Scilla scilloides and has been shown to exhibit anti-tumour activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C58H94O27
Net Charge 0
Average Mass 1223.35080
Monoisotopic Mass 1222.59825
InChI InChI=1S/C58H94O27/c1-8-27(62)29-17-23(2)58(85-29)16-15-56(6)26-9-10-33-54(4,25(26)11-14-57(56,58)7)13-12-34(55(33,5)22-61)81-50-44(73)42(71)38(67)32(80-50)21-76-52-47(36(65)28(63)20-75-52)83-53-48(84-49-43(72)40(69)35(64)24(3)77-49)46(39(68)31(19-60)79-53)82-51-45(74)41(70)37(66)30(18-59)78-51/h23-24,28-53,59-61,63-74H,8-22H2,1-7H3/t23-,24+,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-,56+,57+,58+/m1/s1
InChIKey LLBZPESJRQGYMB-VFEURASPSA-N
SMILES [H][C@]1(O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O)O[C@H]1[C@@]([H])(O[C@H](CO)[C@@H](O)[C@]1([H])O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O[C@@H]1[C@@H](O)[C@@H](O)CO[C@H]1OC[C@H]1O[C@@]([H])(O[C@H]2CC[C@]3(C)C4=C(CC[C@@]3([H])[C@@]2(C)CO)[C@]2(C)CC[C@@]3(O[C@@H](C[C@H]3C)C(=O)CC)[C@@]2(C)CC4)[C@H](O)[C@@H](O)[C@@H]1O
Metabolite of Species Details
Scilla scilloides (NCBI:txid49652) Found in bulb (BTO:0000159). Fresh bulbs See: PubMed
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via saponin )
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing sciscllascilloside E-1 (CHEBI:66439) has role antineoplastic agent (CHEBI:35610)
sciscllascilloside E-1 (CHEBI:66439) has role plant metabolite (CHEBI:76924)
sciscllascilloside E-1 (CHEBI:66439) is a ketone (CHEBI:17087)
sciscllascilloside E-1 (CHEBI:66439) is a oxaspiro compound (CHEBI:37948)
sciscllascilloside E-1 (CHEBI:66439) is a pentacyclic triterpenoid (CHEBI:25872)
sciscllascilloside E-1 (CHEBI:66439) is a pentasaccharide derivative (CHEBI:63566)
sciscllascilloside E-1 (CHEBI:66439) is a primary alcohol (CHEBI:15734)
sciscllascilloside E-1 (CHEBI:66439) is a triterpenoid saponin (CHEBI:61778)
Synonym Source
15-deoxoeucosterol-3-O-α-L-rhamnopyranosyl-(1→2)-[β-D-glucopyranosyl-(1→3)]-β-D-glucopyranosyl-(1→2)-α-L-arabinopyranosyl-(1→6)-β-D-glucopyranoside ChEBI
Registry Number Type Source
6048738 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
12237544 PubMed citation Europe PMC
Last Modified
20 January 2014