input word = C00034425

Metabolite InformationStructural formula
Name 3-O-[beta-D-xylopyranosyl-(1->2)-alpha-L-arabinopyranosyl-(1->6)-2-acetamido-2-deoxy-beta-D-glucopyranosyl] acacic acid lactone
Formula C48H75NO17
Mw 937.50349998
CAS RN 186428-60-4
C_ID C00034425 ,
InChIKey HCPJVMUCDGEUPL-CIYNWMMKNA-N
InChICode InChI=1S/C48H75NO17/c1-21(50)49-32-36(57)35(56)26(20-62-41-38(34(55)25(52)19-61-41)66-40-37(58)33(54)24(51)18-60-40)63-39(32)64-30-12-13-45(6)27(44(30,4)5)11-14-46(7)28(45)10-9-22-23-15-43(2,3)31-17-48(23,42(59)65-31)29(53)16-47(22,46)8/h9,23-41,51-58H,10-20H2,1-8H3,(H,49,50)/t23-,24+,25+,26+,27-,28+,29+,30-,31-,32+,33-,34+,35+,36+,37+,38+,39-,40-,41-,45+,46+,47+,48+/m0/s1
SMILES C1[C@@H](C([C@H]2[C@@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@]3([C@@H](C2)O)C[C@@H](C(C1)(C)C)OC3=O)C)C)C)(C)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1NC(=O)C)O)O)CO[C@H]1[C@@H]([C@@H]([C@@H](CO1)O)O)O[C@H]1[C@@H]([C@H]([C@@H](CO1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp Cholesterol
Organism
Kingdom Family Species Reference
PlantaeFabaceaeAlbizia procera Ref.
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