input word = C00007219

Metabolite InformationStructural formula
Name Butein 3,2'-diglucoside
Formula C27H32O15
Mw 596.17412036
CAS RN
C_ID C00007219 ,
InChIKey FUXWTBSZMHFZRY-FVRIFCRFNA-N
InChICode InChI=1S/C27H32O15/c28-9-18-20(33)22(35)24(37)26(41-18)39-16-8-12(30)3-4-13(16)14(31)5-1-11-2-6-15(32)17(7-11)40-27-25(38)23(36)21(34)19(10-29)42-27/h1-8,18-30,32-38H,9-10H2/b5-1+/t18-,19+,20+,21+,22-,23+,24-,25+,26+,27+/m0/s1
SMILES c1(cc(c(cc1)C(=O)/C=C/c1cc(c(cc1)O)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)CO)O)O)O)O[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnacardiaceaeAmphipterygium adstringens Ref.
PlantaeAnacardiaceaeMetopium brownei Ref.
PlantaeAnacardiaceaeRhus chondroloma Ref.
PlantaeAnacardiaceaeRhus virens Ref.
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