input word = C00006275

Metabolite InformationStructural formula
Name Isoswertisin 2''-O-glucoside
Formula C28H32O15
Mw 608.17412036
CAS RN 89701-83-7
C_ID C00006275 ,
InChIKey XSAFLFYGYGKUKQ-BGCVNJHRNA-N
InChICode InChI=1S/C28H32O15/c1-39-15-7-13(33)18-12(32)6-14(10-2-4-11(31)5-3-10)40-25(18)19(15)26-27(23(37)21(35)16(8-29)41-26)43-28-24(38)22(36)20(34)17(9-30)42-28/h2-7,16-17,20-24,26-31,33-38H,8-9H2,1H3/t16-,17+,20+,21+,22-,23-,24+,26-,27-,28-/m0/s1
SMILES COc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1O[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeGnetaceaeGnetum africanum Ref.
PlantaeGnetaceaeGnetum buchholzianum Ref.
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