input word = C00046408

Metabolite InformationStructural formula
Name Sipholenoside A
(-)-Sipholenoside A
Formula C36H60O8
Mw 620.42881889
CAS RN 329050-22-8
C_ID C00046408 ,
InChIKey HNSOBKBOFOVHBX-XVXZPJGUNA-N
InChICode InChI=1S/C36H60O8/c1-20-10-11-24-23(14-19-36(24,9)44-31-30(40)29(39)28(38)21(2)42-31)32(3,4)22(20)12-13-25-34(7)17-15-26(37)33(5,6)43-27(34)16-18-35(25,8)41/h12,20-21,23-25,27-31,38-41H,10-11,13-19H2,1-9H3/b22-12-/t20-,21+,23-,24-,25-,27-,28+,29-,30-,31+,34-,35+,36-/m1/s1
SMILES C1C(=O)C(O[C@H]2[C@](C1)([C@H]([C@](CC2)(O)C)C/C=C/1\C([C@H]2[C@@H](CC[C@H]1C)[C@@](CC2)(O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O)C)C)(C)C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Siphonochalina siphonella Ref.
zoom in