input word = C00034269

Metabolite InformationStructural formula
Name Sphenadilactone A
(+)-Sphenadilactone A
Formula C29H36O12
Mw 576.22067662
CAS RN 884495-25-4
C_ID C00034269 ,
InChIKey NJTZWXJTMLGIFW-HEXJMRDDNA-N
InChICode InChI=1S/C29H36O12/c1-11-18-19(36-21(11)32)17-20-24(3,22(33)25(17,4)34)15-8-26-9-27-12(23(2,10-30)37-14(27)7-16(31)39-27)5-6-13(26)28(35,38-15)29(20,40-18)41-26/h11-15,17-20,30,34-35H,5-10H2,1-4H3/t11-,12-,13-,14+,15+,17+,18+,19+,20-,23-,24-,25+,26-,27+,28-,29-/m0/s1
SMILES [C@@]123[C@@H](CC[C@H]4[C@]5(C1)O[C@]16[C@]4(O[C@@H]([C@]4([C@@H]1[C@H]([C@](C4=O)(O)C)[C@@H]1[C@H](O6)[C@@H](C(=O)O1)C)C)C5)O)[C@](O[C@@H]2CC(=O)O3)(C)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSchisandraceaeSchisandra sphenanthera Ref.
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