input word = C00031744

Metabolite InformationStructural formula
Name Dichotomoside C
Formula C30H40O13
Mw 608.24689137
CAS RN 845673-19-0
C_ID C00031744 ,
InChIKey JKMGHGDVBFBDHM-ACSYHXPKNA-N
InChICode InChI=1S/C30H40O13/c1-4-5-10-41-24(34)9-7-17-11-18(25(35)20(13-17)39-2)19-12-16(6-8-23(32)33)14-21(40-3)29(19)43-30-28(38)27(37)26(36)22(15-31)42-30/h11-14,22,26-28,30-31,35-38H,4-10,15H2,1-3H3,(H,32,33)/t22-,26-,27+,28-,30+/m1/s1
SMILES CCCCOC(=O)CCc1cc(OC)c(O)c(-c2cc(CCC(=O)O)cc(OC)c2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCaryophyllaceaeStellaria dichotoma L.var.lanceolata Ref.
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