input word = C00033237

Metabolite InformationStructural formula
Name Myrioside B
(+)-Myrioside B
Formula C36H56O10
Mw 648.38734801
CAS RN 471913-92-5
C_ID C00033237 ,
InChIKey RDGWQQQKUDXGRS-NFWTVQMYNA-N
InChICode InChI=1S/C36H56O10/c1-31-13-14-32(2,30(43)44)17-20(31)19-7-8-22-33(3)11-10-23(45-29-26(40)24(38)25(39)27(46-29)28(41)42)34(4,18-37)21(33)9-12-36(22,6)35(19,5)16-15-31/h7,20-27,29,37-40H,8-18H2,1-6H3,(H,41,42)(H,43,44)/t20-,21+,22+,23-,24-,25-,26+,27-,29+,31+,32+,33-,34+,35+,36+/m0/s1
SMILES [C@]1(CC[C@]2([C@@H](C1)C1=CC[C@H]3[C@]([C@@]1(CC2)C)(CC[C@@H]1[C@@]3(CC[C@@H]([C@]1(C)CO)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)C(=O)O)C)C)C)(C)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeOxytropis myriophylla Ref.
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