input word = C00033488

Metabolite InformationStructural formula
Name Wikstroelide M
Formula C34H50O9
Mw 602.3454832
CAS RN 137453-98-6
C_ID C00033488 ,
InChIKey GXMAZRXKZHGJLF-LYNNUUKCNA-N
InChICode InChI=1S/C34H50O9/c1-6-7-8-9-10-11-12-13-14-15-16-17-25(36)42-28-26-29-32(20-35,43-29)30(38)34(41)24(18-22(4)27(34)37)33(26,40)23(5)19-31(28,39)21(2)3/h14-18,23-24,26,28-30,35,38-41H,2,6-13,19-20H2,1,3-5H3/b15-14+,17-16+/t23-,24+,26-,28-,29+,30-,31-,32+,33+,34-/m1/s1
SMILES [C@]12([C@H]3[C@]([C@@H]([C@@]4([C@H]([C@H]1[C@H]([C@@](C[C@H]2C)(C(=C)C)O)OC(=O)/C=C/C=C/CCCCCCCCC)O4)CO)O)(C(=O)C(=C3)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeThymelaeaceaeStellera chamaejasme L. Ref.
PlantaeThymelaeaceaeWikstroemia retusa Ref.
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