input word = C00011132

Metabolite InformationStructural formula
Name Mukaadial 6-O-beta-D-glucopyranoside
Formula C21H32O9
Mw 428.20463262
CAS RN 600736-87-6
C_ID C00011132 ,
InChIKey SHDYCTBDQDSUFQ-NKUHKDALNA-N
InChICode InChI=1S/C21H32O9/c1-19(2)5-4-6-20(3)17(19)12(7-11(8-22)21(20,28)10-24)29-18-16(27)15(26)14(25)13(9-23)30-18/h7-8,10,12-18,23,25-28H,4-6,9H2,1-3H3/t12-,13-,14-,15+,16-,17+,18-,20+,21-/m1/s1
SMILES CC1(C)CCC[C@@]2(C)C1[C@H](O[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1O)C=C(C=O)[C@]2(O)C=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCanellaceaeWarburgia stuhlmannii Ref.
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