input word = C00046926

Metabolite InformationStructural formula
Name Sibiricose A5
(-)-Sibiricose A5
Formula C22H30O14
Mw 518.16355567
CAS RN 107912-97-0
C_ID C00046926 ,
InChIKey ZPEADZHVGOCGKH-OTEKNRLJNA-N
InChICode InChI=1S/C22H30O14/c1-32-12-6-10(2-4-11(12)26)3-5-15(27)34-20-17(29)14(8-24)35-22(20,9-25)36-21-19(31)18(30)16(28)13(7-23)33-21/h2-6,13-14,16-21,23-26,28-31H,7-9H2,1H3/b5-3+/t13-,14-,16-,17-,18+,19-,20+,21-,22+/m1/s1
SMILES COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePolygalaceaePolygala arillata Ref.
PlantaePolygalaceaePolygala sibirica Ref.
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