input word = C00032237

Metabolite InformationStructural formula
Name Sublanceoside H2
(-)-Sublanceoside H2
Formula C48H74O20
Mw 970.47734481
CAS RN 923021-28-7
C_ID C00032237 ,
InChIKey GZPAIOJUUWWJCN-ANXGSTKDNA-N
InChICode InChI=1S/C48H74O20/c1-21-42(66-36-15-31(56-7)43(22(2)61-36)67-37-16-32(57-8)44(23(3)62-37)68-46-41(53)40(52)39(51)33(18-49)65-46)30(55-6)14-35(60-21)63-29-13-25-10-11-26-27(47(25,4)17-28(29)50)12-9-24-19-58-48(5)38(24)34(20-59-48)64-45(26)54/h10,19,21-23,26-44,46,49-53H,9,11-18,20H2,1-8H3/t21-,22-,23+,26-,27+,28-,29-,30+,31+,32-,33-,34-,35+,36+,37+,38-,39+,40+,41-,42-,43-,44+,46+,47+,48+/m1/s1
SMILES C1C2=CO[C@@]3([C@H]2[C@H](OC(=O)[C@H]2[C@H](C1)[C@@]1(C(=CC2)C[C@H]([C@@H](C1)O)O[C@@H]1O[C@@H]([C@H]([C@H](C1)OC)O[C@H]1C[C@@H]([C@@H]([C@H](O1)C)O[C@@H]1O[C@H]([C@@H]([C@@H](C1)OC)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)C)OC)C)C)CO3)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCynanchum sublanceolatum Ref.
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