input word = C00032421

Metabolite InformationStructural formula
Name Trilocularol A
(+)-Trilocularol A
Formula C30H52O5
Mw 492.38147477
CAS RN 640279-53-4
C_ID C00032421 ,
InChIKey LCDLXSRJFJBHFD-CPNNTJDDNA-N
InChICode InChI=1S/C30H52O5/c1-18(17-31)9-8-13-30(7,35)24-19-10-11-22-27(4)14-12-23(34)26(2,3)25(27)21(33)16-29(22,6)28(19,5)15-20(24)32/h9,19-25,31-35H,8,10-17H2,1-7H3/b18-9-/t19-,20-,21+,22-,23+,24-,25+,27-,28-,29-,30+/m1/s1
SMILES C1[C@@H](C([C@H]2[C@](C1)([C@@H]1[C@@](C[C@@H]2O)([C@]2([C@H](CC1)[C@H]([C@@H](C2)O)[C@@](CC/C=C(/C)\CO)(C)O)C)C)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMalvaceaeCorchorus trilocularis L. Ref.
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