CHEBI:70248 - 25-O-acetylcimigenol 3-O-alpha-L-arabinopyranoside

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ChEBI Name 25-O-acetylcimigenol 3-O-alpha-L-arabinopyranoside
ChEBI ID CHEBI:70248
Definition A natural product found in Actaea racemosa.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C37H58O10
Net Charge 0
Average Mass 662.85040
Monoisotopic Mass 662.40300
InChI InChI=1S/C37H58O10/c1-18-15-21-28(32(5,6)45-19(2)38)47-37(46-21)27(18)33(7)13-14-36-17-35(36)12-11-24(44-29-26(41)25(40)20(39)16-43-29)31(3,4)22(35)9-10-23(36)34(33,8)30(37)42/h18,20-30,39-42H,9-17H2,1-8H3/t18-,20+,21-,22+,23+,24+,25+,26-,27-,28+,29+,30-,33-,34-,35-,36+,37+/m1/s1
InChIKey NNFJPOSVDKIWPO-VYWUFNEXSA-N
SMILES [H][C@@]12C[C@@H](C)[C@]3([H])[C@@]4(C)CC[C@@]56C[C@@]55CC[C@H](O[C@]7([H])OC[C@H](O)[C@H](O)[C@H]7O)C(C)(C)[C@]5([H])CC[C@@]6([H])[C@]4(C)[C@@H](O)[C@]3(O[C@@H]1C(C)(C)OC(C)=O)O2
Metabolite of Species Details
Actaea racemosa (NCBI:txid64040) Found in rhizome (BTO:0001181). Methanolic extract of dried, ground rhizomes See: PubMed
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.
allelochemical
A class of secondary metabolites developed by many plants to influence the behaviour, growth or survival of herbivores, and thus acting as a defence against herbivory.
(via cucurbitacin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 25-O-acetylcimigenol 3-O-alpha-L-arabinopyranoside (CHEBI:70248) has role metabolite (CHEBI:25212)
25-O-acetylcimigenol 3-O-alpha-L-arabinopyranoside (CHEBI:70248) is a cucurbitacin (CHEBI:16219)
25-O-acetylcimigenol 3-O-alpha-L-arabinopyranoside (CHEBI:70248) is a glycoside (CHEBI:24400)
Citation Waiting for Citations Type Source
21082802 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:triterpenoid(CHEBI:36615); ISA:hydroxy steroid(CHEBI:35350); ISA:glycoside(CHEBI:24400); ISA:oxacycle(CHEBI:38104); ISA:monosaccharide(CHEBI:35381); ISA:oxanes(CHEBI:46942); ISA:dioxolane(CHEBI:39430); ISA:organic hydroxy compound(CHEBI:33822); ISA:carboxylic ester(CHEBI:33308); ISA:secondary alcohol(CHEBI:35681); ISA:polyol(CHEBI:26191); ISA:acetal(CHEBI:59769); ISA:organonitrogen compound(CHEBI:35352); ISA:carbonyl compound(CHEBI:36586);