input word = C00034810

Metabolite InformationStructural formula
Name Calceolarioside C
Formula C28H34O15
Mw 610.18977042
CAS RN 114217-04-8
C_ID C00034810 ,
InChIKey GNDDBOHLMOANGU-ZZXKWVIFNA-N
InChICode InChI=1S/C28H34O15/c29-15-4-1-13(9-17(15)31)3-6-21(34)43-26-20(12-41-27-24(37)22(35)19(33)11-40-27)42-28(25(38)23(26)36)39-8-7-14-2-5-16(30)18(32)10-14/h1-6,9-10,19-20,22-33,35-38H,7-8,11-12H2/b6-3+/t19-,20+,22-,23-,24-,25+,26+,27+,28-/m1/s1
SMILES O=C(/C=C/c1ccc(O)c(O)c1)OC1C(COC2OCC(O)C(O)C2O)OC(OCCc2ccc(O)c(O)c2)C(O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOleaceaeNyctanthes arbor-tristis L. Ref.
PlantaePlantaginaceaeVeronica anagallis-aquatica Ref.
PlantaeScrophulariaceaeEllisiophyllum pinnatum (Wall.ex.Benth.) Ref.
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OrganismNyctanthes arbor-tristis L.
ReferenceJensen,Phytochem.,60,(2002),213