input word = C00010182

Metabolite InformationStructural formula
Name 12-Dihydrodalbinol O-glucoside
12-Dihydrodalbin
Formula C29H34O13
Mw 590.19994117
CAS RN 97640-97-6
C_ID C00010182 ,
InChIKey SFNXYXPFXFEMOK-MRNFBESGNA-N
InChICode InChI=1S/C29H34O13/c1-12(10-39-28-25(33)24(32)23(31)21(9-30)41-28)17-6-14-16(40-17)5-4-13-26(14)42-22-11-38-18-8-20(37-3)19(36-2)7-15(18)29(22,35)27(13)34/h4-5,7-8,17,21-25,27-28,30-35H,1,6,9-11H2,2-3H3/t17-,21-,22+,23-,24+,25-,27-,28-,29+/m1/s1
SMILES C(C(=C)[C@H]1Cc2c(ccc3c2O[C@@H]2[C@]([C@@H]3O)(c3cc(c(cc3OC2)OC)OC)O)O1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeDalbergia monetaria Ref.
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