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CHEBI:80735 - sennoside D

Default Structure
ChEBI IDCHEBI:80735
ChEBI Namesennoside D
Stars
Last Modified6 January 2015
DownloadsMolfile
FormulaC42H40O19
Net Charge0
Average Mass848.763
Monoisotopic Mass848.21638
SMILES[H][C@]1([C@]2([H])c3cc(CO)cc(O)c3C(=O)c3c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cccc32)c2cc(C(=O)O)cc(O)c2C(=O)c2c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cccc21
InChIInChI=1S/C42H40O19/c43-11-14-7-18-26(16-3-1-5-22(30(16)34(50)28(18)20(46)8-14)58-41-38(54)36(52)32(48)24(12-44)60-41)27-17-4-2-6-23(59-42-39(55)37(53)33(49)25(13-45)61-42)31(17)35(51)29-19(27)9-15(40(56)57)10-21(29)47/h1-10,24-27,32-33,36-39,41-49,52-55H,11-13H2,(H,56,57)/t24-,25-,26+,27-,32-,33-,36+,37+,38-,39-,41-,42-/m1/s1
InChIKeyZFWOUNNKSHIAFK-MIIKWYNKSA-N
Roles Classification
Biological Roles:
cathartic  Any substance that accelerates defecation. Compare with laxatives, which are substances that ease defecation (usually by softening faeces). A substance can be both a laxative and a cathartic.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Application:
laxative  An agent that produces a soft formed stool, and relaxes and loosens the bowels, typically used over a protracted period, to relieve constipation. Compare with cathartic, which is a substance that accelerates defecation. A substances can be both a laxative and a cathartic.
ChEBI Ontology
Outgoing Relation(s)
sennoside D (CHEBI:80735) is a sennosides (CHEBI:84154)
Synonym  Source
Sennidin DKEGG COMPOUND
Manual XrefsDatabases
C16798KEGG COMPOUND
Registry NumbersSources
CAS:37271-17-3KEGG COMPOUND