input word = C00012874

Metabolite InformationStructural formula
Name Pulchellin F
[3aR-[3aalpha,4aalpha,6beta,7alpha(Z),8abeta,9aalpha]]-Dodecahydro-6-hydroxy-8a-methyl-3,5-bis(methylene)-2-oxonaphtho[2,3-b]furan-7-yl ester 2-methyl-2-butenoic acid
Formula C20H26O5
Mw 346.17802394
CAS RN 22850-61-9
C_ID C00012874 ,
InChIKey WQDAWTVPENXPFQ-ALBLZXQENA-N
InChICode InChI=1S/C20H26O5/c1-6-10(2)18(22)25-16-9-20(5)8-15-13(11(3)19(23)24-15)7-14(20)12(4)17(16)21/h6,13-17,21H,3-4,7-9H2,1-2,5H3/b10-6-/t13-,14+,15-,16-,17-,20-/m1/s1
SMILES C1(=C)[C@H]2[C@@](C[C@H]([C@@H]1O)OC(=O)/C(=C\C)/C)(C[C@@H]1[C@H](C2)C(=C)C(=O)O1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeGaillardia pulchella Ref.
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