input word = C00039551

Metabolite InformationStructural formula
Name Kadsuralignan K
Formula C29H30O8
Mw 506.19406794
CAS RN 960511-19-7
C_ID C00039551 ,
InChIKey BRYKANSBPAKIAC-UHFFFAOYNA-N
InChICode InChI=1S/C29H30O8/c1-15-11-18-12-20(32-3)25(33-4)28(37-29(31)17-9-7-6-8-10-17)22(18)23-19(24(30)16(15)2)13-21-26(27(23)34-5)36-14-35-21/h6-10,12-13,15-16,24,30H,11,14H2,1-5H3/t15-,16-,24+/m1/s1
SMILES c12c([C@H]([C@@H]([C@@H](Cc3c1c(c(c(c3)OC)OC)OC(=O)c1ccccc1)C)C)O)cc1c(c2OC)OCO1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSchisandraceaeKadsura coccinea Ref.
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