input word = C00023926

Metabolite InformationStructural formula
Name Hebevinoside XII
16-3-O-beta-D-Xylopyranoside-16-O-(4,6-di-O-acetyl)-beta-D-glucopuranoside
Formula C43H70O13
Mw 794.48164232
CAS RN 138995-51-4
C_ID C00023926 ,
InChIKey TZFLXDBCBUACKU-PHFQSRKANA-N
InChICode InChI=1S/C43H70O13/c1-21(2)11-10-12-22(3)31-28(54-39-35(51)33(49)36(53-23(4)45)29(19-44)55-39)18-43(9)37-26(46)17-25-24(41(37,7)15-16-42(31,43)8)13-14-30(40(25,5)6)56-38-34(50)32(48)27(47)20-52-38/h11,17,22,24,26-39,44,46-51H,10,12-16,18-20H2,1-9H3/t22-,24-,26+,27-,28+,29-,30+,31-,32+,33-,34+,35-,36+,37+,38+,39+,41+,42-,43-/m1/s1
SMILES C1[C@@H](C(C2=C[C@@H]([C@H]3[C@]([C@@H]2C1)(CC[C@]1([C@@]3(C[C@@H]([C@H]1[C@@H](CCC=C(C)C)C)O[C@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)OC(=O)C)CO)C)C)C)O)(C)C)O[C@H]1[C@H]([C@H]([C@@H](CO1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiHymenogastraceaeHebeloma vinosphyllum Ref.
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