input word = C00008863

Metabolite InformationStructural formula
Name Plumerubroside
Formula C24H30O12
Mw 510.17372642
CAS RN 131189-52-1
C_ID C00008863 ,
InChIKey IBKHAIJVZGYPDV-GWTXFMPINA-N
InChICode InChI=1S/C24H30O12/c1-31-11-6-14-12(15(7-11)35-24-22(30)21(29)20(28)18(9-25)36-24)8-13(26)23(34-14)10-4-16(32-2)19(27)17(5-10)33-3/h4-7,13,18,20-30H,8-9H2,1-3H3/t13-,18+,20+,21-,22+,23+,24+/m0/s1
SMILES c1(cc(c2c(c1)O[C@@H]([C@H](C2)O)c1cc(c(c(c1)OC)O)OC)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaePlumeria rubra Ref.
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