input word = C00040450

Metabolite InformationStructural formula
Name Tasumatrol Y
Formula C29H34O10
Mw 542.21519731
CAS RN 1013025-37-0
C_ID C00040450 ,
InChIKey MBFIOFDQFUMPRF-XBLSOMKBNA-N
InChICode InChI=1S/C29H34O10/c1-15-10-11-26(25(3,4)34)20(15)29(35)24(33)37-13-27(29)18(31)12-19-28(14-36-19,39-16(2)30)21(27)22(26)38-23(32)17-8-6-5-7-9-17/h5-9,18-19,21-22,31,34-35H,10-14H2,1-4H3/t18-,19+,21-,22-,26-,27+,28-,29+/m0/s1
SMILES [C@H]1([C@]2(C(=C(CC2)C)[C@@]2([C@]3([C@H]1[C@]1([C@@H](C[C@@H]3O)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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