input word = C00030717

Metabolite InformationStructural formula
Name Manglieside B
Formula C20H28O11
Mw 444.16316174
CAS RN 1093091-41-8
C_ID C00030717 ,
InChIKey IJQCJDUCBNKRAY-RZEWBBRLNA-N
InChICode InChI=1S/C20H28O11/c1-2-3-10-4-5-11(22)12(6-10)30-18-16(25)15(24)14(23)13(31-18)7-28-19-17(26)20(27,8-21)9-29-19/h2,4-6,13-19,21-27H,1,3,7-9H2/t13-,14-,15+,16-,17+,18-,19-,20-/m1/s1
SMILES [C@@H]1([C@@H]([C@H]([C@@H](O[C@@H]1CO[C@@H]1OC[C@]([C@H]1O)(O)CO)Oc1c(ccc(c1)CC=C)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMagnoliaceaeManglietia phuthoensis Ref.
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OrganismManglietia phuthoensis
ReferenceKiem,Chem.Pharm.Bull.,56,(2008),1270