input word = C00040447

Metabolite InformationStructural formula
Name Tasumatrol V
Formula C31H36O12
Mw 600.22067662
CAS RN 1013025-33-6
C_ID C00040447 ,
InChIKey UHYTXVUDJYACPP-LDJKYMHYNA-N
InChICode InChI=1S/C31H36O12/c1-15-19(34)12-28(27(4,5)37)22(15)31(38)26(36)40-13-29(31)20(41-16(2)32)11-21-30(14-39-21,43-17(3)33)23(29)24(28)42-25(35)18-9-7-6-8-10-18/h6-10,19-21,23-24,34,37-38H,11-14H2,1-5H3/t19-,20-,21+,23+,24-,28-,29+,30-,31+/m0/s1
SMILES [C@H]1([C@]2(C(=C([C@H](C2)O)C)[C@@]2([C@]3([C@@H]1[C@]1([C@@H](C[C@@H]3OC(=O)C)OC1)OC(=O)C)COC2=O)O)C(O)(C)C)OC(=O)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus sumatrana Ref.
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