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CHEBI:70245 - Cimiracemoside F

Default Structure
ChEBI IDCHEBI:70245
ChEBI NameCimiracemoside F
Stars
DefinitionA natural product found in Actaea racemosa.
Last Modified22 September 2014
DownloadsMolfile
FormulaC37H56O11
Net Charge0
Average Mass676.844
Monoisotopic Mass676.38226
SMILES[H][C@@]1(O[C@H]2CC[C@]34C[C@]35C[C@@H](OC(C)=O)[C@]3(C)[C@@]6([H])[C@H](C)[C@@]7([H])OC(C)(C)[C@@H](O)[C@@]7(O)O[C@@]6([H])C[C@@]3(C)C5=CC[C@@]4([H])C2(C)C)OC[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C37H56O11/c1-17-25-20(47-37(43)28(17)48-32(5,6)30(37)42)13-33(7)22-10-9-21-31(3,4)23(46-29-27(41)26(40)19(39)15-44-29)11-12-35(21)16-36(22,35)14-24(34(25,33)8)45-18(2)38/h10,17,19-21,23-30,39-43H,9,11-16H2,1-8H3/t17-,19+,20-,21-,23-,24+,25-,26-,27+,28+,29-,30+,33-,34+,35+,36-,37-/m0/s1
InChIKeyIHMRHYCBRKQAFU-CCPRSJHGSA-N
Species of MetaboliteComponentSourceComments
Actaea racemosa (ncbitaxon:64040) rhizome (BTO:0001181) PubMed (21082802) Methanolic extract of dried, ground rhizomes
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)
Cimiracemoside F (CHEBI:70245) has role metabolite (CHEBI:25212)
Cimiracemoside F (CHEBI:70245) is a triterpenoid (CHEBI:36615)
Citations