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CHEBI:70384 - rabdosichuanin A

ChEBI IDCHEBI:70384
ChEBI Namerabdosichuanin A
Stars
DefinitionA natural product found in Isodon eriocalyx.
Last Modified22 September 2014
DownloadsMolfile
FormulaC22H30O7
Net Charge0
Average Mass406.475
Monoisotopic Mass406.19915
SMILES[H][C@@]12C[C@H](O)[C@]3([H])[C@](C1)(C(=O)OC[C@]31[C@@H](OC(C)=O)CCC(C)(C)[C@H]1C=O)C(=O)[C@@H]2C
InChIInChI=1S/C22H30O7/c1-11-13-7-14(25)17-21(8-13,18(11)26)19(27)28-10-22(17)15(9-23)20(3,4)6-5-16(22)29-12(2)24/h9,11,13-17,25H,5-8,10H2,1-4H3/t11-,13-,14+,15-,16+,17-,21+,22+/m1/s1
InChIKeyFOZIRCRTSCHOHT-TUXYLBHMSA-N
Species of MetaboliteComponentSourceComments
Isodon eriocalyx (IPNI:448573-1) aerial part (BTO:0001658) PubMed (20949916) 70% aqueous Me2CO extract of air-dried and powdered aerial parts
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)
rabdosichuanin A (CHEBI:70384) has role metabolite (CHEBI:25212)
rabdosichuanin A (CHEBI:70384) is a δ-lactone (CHEBI:18946)
Citations