input word = C00003377

Metabolite InformationStructural formula
Name Triobolide
Formula C27H38O10
Mw 522.24649744
CAS RN 50657-07-3
C_ID C00003377 ,
InChIKey FIAZIVNRHQWTPY-YBOSMBJJNA-N
InChICode InChI=1S/C27H38O10/c1-9-13(3)22(29)34-18-11-17-20(15(18)5)21-27(33,26(8,32)24(31)36-21)19(35-23(30)14(4)10-2)12-25(17,7)37-16(6)28/h9,14,17-19,21,32-33H,10-12H2,1-8H3/b13-9-/t14-,17-,18+,19-,21-,25-,26+,27+/m0/s1
SMILES [C@H]12C(=C([C@@H](C2)OC(=O)/C(=C\C)/C)C)[C@H]2[C@]([C@H](C[C@@]1(OC(=O)C)C)OC(=O)[C@H](CC)C)([C@@](C(=O)O2)(O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeLaser trilobum Ref.
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