input word = C00030580

Metabolite InformationStructural formula
Name Kadsuralignan B
Formula C27H32O11
Mw 532.19446187
CAS RN 913183-88-7
C_ID C00030580 ,
InChIKey JTGLGTVZVIMKBZ-UHFFFAOYNA-N
InChICode InChI=1S/C27H32O11/c1-12-21(37-13(2)28)15-9-18-23(36-11-35-18)25(34-8)19(15)20-16(26(27(12,4)30)38-14(3)29)10-17(31-5)22(32-6)24(20)33-7/h9-10,12,21,26,30H,11H2,1-8H3/t12-,21-,26-,27+/m1/s1
SMILES c12c([C@@H]([C@H]([C@]([C@@H](c3c1c(c(c(c3)OC)OC)OC)OC(=O)C)(C)O)C)OC(=O)C)cc1c(c2OC)OCO1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSchisandraceaeKadsura coccinea Ref.
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