input word = C00010492

Metabolite InformationStructural formula
Name Asystasioside B
Formula C22H32O14
Mw 520.17920573
CAS RN 126005-82-1
C_ID C00010492 ,
InChIKey BYKMNZSGGUOZES-ZWEADXQPNA-N
InChICode InChI=1S/C22H32O14/c1-7-2-3-8-9(19(31)35-21-17(29)15(27)13(25)10(4-23)33-21)6-32-20(12(7)8)36-22-18(30)16(28)14(26)11(5-24)34-22/h2,6,8,10-18,20-30H,3-5H2,1H3/t8-,10-,11-,12-,13-,14-,15+,16-,17+,18+,20+,21+,22+/m1/s1
SMILES CC1=CC[C@@H]2C(C(=O)O[C@@H]3OC(CO)[C@@H](O)C(O)[C@@H]3O)=CO[C@@H](O[C@@H]3OC(CO)[C@@H](O)C(O)[C@@H]3O)[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeAsystasia bella Ref.
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