input word = C00021402

Metabolite InformationStructural formula
Name Lancerodiol 6-(4-methoxybenzoate)
Formula C23H30O5
Mw 386.20932407
CAS RN 96853-59-7
C_ID C00021402 ,
InChIKey YHRPDPXNYVRMMK-MSHHELIXNA-N
InChICode InChI=1S/C23H30O5/c1-14(2)23(26)11-10-22(4)13-18(24)15(3)12-19(20(22)23)28-21(25)16-6-8-17(27-5)9-7-16/h6-9,12,14,19-20,26H,10-11,13H2,1-5H3/t19-,20-,22-,23-/m1/s1
SMILES [C@@]12([C@@H]([C@@H](C=C(C(=O)C1)C)OC(=O)c1ccc(cc1)OC)[C@@](CC2)(C(C)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula lancerottensis Ref.
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