input word = C00047996

Metabolite InformationStructural formula
Name Methylmitrekaurenate
Formula C21H30O6
Mw 378.20423869
CAS RN 81093-11-0
C_ID C00047996 ,
InChIKey KXRIJKYODUQSSO-BCMDMHHCNA-N
InChICode InChI=1S/C21H30O6/c1-12-10-21(17(24)25)11-13(12)6-7-14(21)19(2)8-5-9-20(3,18(26)27-4)15(19)16(22)23/h13-15H,1,5-11H2,2-4H3,(H,22,23)(H,24,25)/t13-,14+,15+,19-,20-,21+/m1/s1
SMILES C1C(=C)[C@@H]2CC[C@H]([C@]1(C2)C(=O)O)[C@@]1([C@@H]([C@@](CCC1)(C(=O)OC)C)C(=O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeMitrephora glabra Ref.
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