input word = C00023925

Metabolite InformationStructural formula
Name Hebevinoside XI
7-3-O-beta-D-Xylopyranoside-16-O-(4,6-di-O-acetyl)-beta-D-glucopyranoside
Formula C46H74O14
Mw 850.50785707
CAS RN 101365-13-3
C_ID C00023925 ,
InChIKey BDIZCZITXGMZCF-YSFLWBDVNA-N
InChICode InChI=1S/C46H74O14/c1-23(2)13-12-14-24(3)34-31(58-42-38(53)36(51)39(57-26(5)48)32(59-42)22-55-25(4)47)20-46(10)40-30(54-11)19-28-27(44(40,8)17-18-45(34,46)9)15-16-33(43(28,6)7)60-41-37(52)35(50)29(49)21-56-41/h13,19,24,27,29-42,49-53H,12,14-18,20-22H2,1-11H3/t24-,27-,29-,30+,31+,32+,33+,34+,35-,36+,37-,38-,39-,40-,41-,42?,44+,45+,46+/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)OC)(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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