input word = C00032932

Metabolite InformationStructural formula
Name Egonol gentiobioside
Formula C31H38O15
Mw 650.22107055
CAS RN 77701-99-6
C_ID C00032932 ,
InChIKey NBGJGWFIDMDCAW-YHLAQWCLNA-N
InChICode InChI=1S/C31H38O15/c1-39-20-8-14(7-16-10-18(44-29(16)20)15-4-5-17-19(9-15)43-13-42-17)3-2-6-40-30-27(37)26(36)24(34)22(46-30)12-41-31-28(38)25(35)23(33)21(11-32)45-31/h4-5,7-10,21-28,30-38H,2-3,6,11-13H2,1H3/t21-,22-,23+,24+,25+,26+,27-,28-,30-,31-/m1/s1
SMILES c1c(cc2c(c1OC)oc(c2)c1cc2c(cc1)OCO2)CCCO[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPolyporaceaeLaetiporus sulphureus var.miniatus Ref.
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