input word = C00035681

Metabolite InformationStructural formula
Name Marsdenoside D
(+)-Marsdenoside D
Formula C40H64O13
Mw 752.43469213
CAS RN 858360-59-5
C_ID C00035681 ,
InChIKey CIPJAECZXQZUDT-NVBPWBNTNA-N
InChICode InChI=1S/C40H64O13/c1-10-19(2)35(45)52-34-30(44)33-37(6)14-12-24(17-23(37)11-15-39(33)40(53-39)16-13-25(20(3)41)38(34,40)7)50-27-18-26(46-8)31(22(5)48-27)51-36-29(43)32(47-9)28(42)21(4)49-36/h19,21-34,36,42-44H,10-18H2,1-9H3/t19-,21+,22+,23-,24-,25-,26+,27-,28+,29+,30-,31+,32+,33+,34+,36-,37-,38-,39-,40+/m0/s1
SMILES C1[C@@H](C[C@H]2[C@](C1)([C@@H]1[C@@]3(CC2)[C@@]2([C@]([C@@H]([C@H]1O)OC(=O)[C@H](CC)C)([C@@H](CC2)C(=O)C)C)O3)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)C)O)OC)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeMarsdenia tenacissima Ref.
zoom in



OrganismMarsdenia tenacissima
ReferenceDeng,Phytochem.,66,(2005),1040