input word = C00010566

Metabolite InformationStructural formula
Name Asystasioside D
Formula C22H32O15
Mw 536.17412036
CAS RN 126005-84-3
C_ID C00010566 ,
InChIKey PWXCUOHQDMIEHV-ZWEADXQPNA-N
InChICode InChI=1S/C22H32O15/c23-3-7-1-2-8-9(19(32)36-21-17(30)15(28)13(26)10(4-24)34-21)6-33-20(12(7)8)37-22-18(31)16(29)14(27)11(5-25)35-22/h1,6,8,10-18,20-31H,2-5H2/t8-,10-,11+,12-,13-,14-,15-,16-,17+,18+,20+,21+,22+/m1/s1
SMILES O=C(O[C@@H]1OC(CO)[C@@H](O)C(O)[C@@H]1O)C1=CO[C@@H](O[C@@H]2OC(CO)[C@@H](O)C(O)[C@@H]2O)[C@@H]2C(CO)=CC[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeAsystasia bella Ref.
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