input word = C00032229

Metabolite InformationStructural formula
Name Sublanceoside E4
(-)-Sublanceoside E4
Formula C41H62O14
Mw 778.41395669
CAS RN 923021-21-0
C_ID C00032229 ,
InChIKey YXLVNOKXFPNDMG-UGMNLSHQNA-N
InChICode InChI=1S/C41H62O14/c1-19-34(44)28(45-6)14-33(49-19)54-35-20(2)50-31(13-25(35)42)55-36-21(3)51-32(15-29(36)46-7)52-27-12-22-8-9-23-24(39(22,4)16-26(27)43)10-11-41-18-48-40(5)37(41)30(17-47-40)53-38(23)41/h8,19-21,24-37,42-44H,9-18H2,1-7H3/t19-,20+,21+,24-,25-,26+,27+,28+,29-,30+,31-,32-,33-,34-,35+,36+,37+,39-,40+,41-/m0/s1
SMILES CO[C@H]1C[C@H](O[C@@H]2CC3=CCC4=C5O[C@@H]6CO[C@]7(C)OC[C@@]5(CC[C@@H]4[C@@]3(C)C[C@H]2O)[C@H]67)O[C@H](C)[C@H]1O[C@H]1C[C@H](O)[C@H](O[C@H]2C[C@@H](OC)[C@@H](O)[C@H](C)O2)[C@@H](C)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCynanchum sublanceolatum Ref.
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