input word = C00012904

Metabolite InformationStructural formula
Name [4aR-[4aalpha,5alpha,6alpha(2S*,3R*),8abeta]]-4,4a,5,6,7,8,8a,9-Octahydro-5-hydroxy-3,5,8a-trimethylnaphtho[2,3-b]furan-6-yl ester 2,3-dimethyloxiranecarboxylic acid
Formula C20H28O5
Mw 348.193674
CAS RN 125164-75-2
C_ID C00012904 ,
InChIKey WXRQALXHCUURIK-KSJZGZRHNA-N
InChICode InChI=1S/C20H28O5/c1-11-10-23-14-9-18(3)7-6-16(19(4,22)15(18)8-13(11)14)24-17(21)20(5)12(2)25-20/h10,12,15-16,22H,6-9H2,1-5H3/t12-,15-,16-,18-,19+,20+/m1/s1
SMILES Cc1coc2c1C[C@@H]1[C@](C)(CC[C@@H](OC(=O)[C@@]3(C)O[C@@H]3C)[C@@]1(C)O)C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEpaltes gariepina Ref.
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