input word = C00041126

Metabolite InformationStructural formula
Name Stenopaluside
(-)-Stenopaluside
Formula C38H66O14
Mw 746.44525682
CAS RN 220874-90-8
C_ID C00041126 ,
InChIKey KBXNEBNGESWLJM-LFCRHREPNA-N
InChICode InChI=1S/C38H66O14/c1-19(9-10-21(3)49-35-32(47)30(45)28(43)26(17-39)51-35)23(5)25(42)12-14-38(8,34-20(2)15-24(41)16-37(34,6)7)13-11-22(4)50-36-33(48)31(46)29(44)27(18-40)52-36/h20-22,26-36,39-40,43-48H,9-18H2,1-8H3/b23-19-/t20-,21-,22-,26-,27-,28-,29-,30+,31+,32-,33-,34+,35-,36-,38+/m1/s1
SMILES C/C(CCC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C(C)C(=O)CCC(C)(CCC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H]1[C@H](C)CC(=O)CC1(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBlechnaceaeStenochlaena palustris Ref.
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OrganismStenochlaena palustris
ReferenceLiu,Phytochem.,49,(1998),2403