input word = C00032240

Metabolite InformationStructural formula
Name Sublanceoside I1
(-)-Sublanceoside I1
Formula C41H62O13
Mw 762.41904207
CAS RN 923021-31-2
C_ID C00032240 ,
InChIKey XKWWUEUBVBEWMG-YIXXKYBVNA-N
InChICode InChI=1S/C41H62O13/c1-20-25(13-14-48-20)26-11-12-28-27(38(26)44)10-9-24-15-30(29(42)19-41(24,28)5)52-34-17-32(46-7)39(22(3)50-34)54-36-18-33(47-8)40(23(4)51-36)53-35-16-31(45-6)37(43)21(2)49-35/h9,13-14,21-23,26-37,39-40,42-43H,10-12,15-19H2,1-8H3/t21-,22-,23+,26-,27-,28+,29-,30-,31+,32+,33+,34+,35+,36+,37-,39-,40-,41+/m1/s1
SMILES C1[C@@H](C(=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)OC)C)C)c1c(occ1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCynanchum sublanceolatum Ref.
zoom in