input word = C00023923

Metabolite InformationStructural formula
Name Hebevinoside VIII
6-3-O-(4-O-Acetyl)-beta-D-xylopyranoside-16-O-(4,6-di-O-acetyl)-beta-D-glucopyranoside
Formula C47H74O15
Mw 878.5027717
CAS RN 101365-10-0
C_ID C00023923 ,
InChIKey CASUNJDNTPMYBY-TUJNPVFRNA-N
InChICode InChI=1S/C47H74O15/c1-23(2)13-12-14-24(3)35-31(60-43-39(55)37(53)40(59-27(6)50)33(61-43)22-56-25(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)62-42-38(54)36(52)32(21-57-42)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-/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)COC(=O)C)C)C)C)O)(C)C)O[C@@H]1[C@@H]([C@@H]([C@H](CO1)OC(=O)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiHymenogastraceaeHebeloma vinosphyllum Ref.
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