input word = C00054066

Metabolite InformationStructural formula
Name Corchoside A
Corchoroside A
Formula C29H42O9
Mw 534.28288294
CAS RN 508-76-9
C_ID C00054066
InChIKey QBILRDAMJUPXCX-PDSBPYSYSA-N
InChICode InChI=1S/C29H42O9/c1-16-25(33)22(31)12-24(37-16)38-18-3-8-27(15-30)20-4-7-26(2)19(17-11-23(32)36-14-17)6-10-29(26,35)21(20)5-9-28(27,34)13-18/h11,15-16,18-22,24-25,31,33-35H,3-10,12-14H2,1-2H3/t16-,18+,19-,20+,21-,22+,24+,25+,26-,27+,28+,29+/m1/s1
SMILES C[C@@]12[C@@](CC[C@@]2(C3=CC(OC3)=O)[H])(O)[C@]4([H])CC[C@]5(O)C[C@@H](O[C@H]6C[C@H](O)[C@@H](O)[C@@H](C)O6)CC[C@]5(C=O)[C@@]4([H])CC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeHesperis matronalis Ref.
PlantaeMalvaceaeCorchorus olitorius Ref.
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