input word = C00023928

Metabolite InformationStructural formula
Name Hebevinoside XIV
16-3-O-(3,4-Di-o-acetyl)-beta-D-Xylopyranoside-16-O-(4,6-di-O-acetyl)-beta-D-glucopyranoside
Formula C47H74O15
Mw 878.5027717
CAS RN 138995-53-6
C_ID C00023928 ,
InChIKey HZVGDAABVDIGIT-CUKGCLDBNA-N
InChICode InChI=1S/C47H74O15/c1-23(2)13-12-14-24(3)35-31(60-43-38(54)37(53)36(52)32(61-43)21-56-25(4)48)20-47(11)41-30(51)19-29-28(45(41,9)17-18-46(35,47)10)15-16-34(44(29,7)8)62-42-39(55)40(59-27(6)50)33(22-57-42)58-26(5)49/h13,19,24,28,30-43,51-55H,12,14-18,20-22H2,1-11H3/t24-,28+,30-,31-,32-,33-,34-,35-,36-,37+,38+,39+,40-,41-,42-,43-,45-,46-,47-/m0/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)O)COC(=O)C)C)C)C)O)(C)C)O[C@H]1[C@@H]([C@H]([C@H](CO1)OC(=O)C)OC(=O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiHymenogastraceaeHebeloma vinosphyllum Ref.
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