input word = C00017441

Metabolite InformationStructural formula
Name [4S-[4alpha,4aalpha,5alpha,6alpha(Z),8aalpha,9abeta]]-2,4,4a,5,6,7,8,8a,9,9a-Decahydro-4,8a-dihydroxy-9a-methoxy-3,4a,5-trimethyl-2-oxonaphtho[2,3-b]furan-6-yl ester 2-methyl-2-butenoic acid
Formula C21H30O7
Mw 394.19915331
CAS RN 130395-62-9
C_ID C00017441 ,
InChIKey ATTRXTZPTLILCG-VFKLKNIINA-N
InChICode InChI=1S/C21H30O7/c1-7-11(2)17(23)27-14-8-9-20(25)10-21(26-6)15(12(3)18(24)28-21)16(22)19(20,5)13(14)4/h7,13-14,16,22,25H,8-10H2,1-6H3/b11-7-/t13-,14-,16+,19-,20-,21+/m0/s1
SMILES C1[C@@H]([C@@H]([C@@]2([C@](C1)(C[C@@]1(C(=C(C(=O)O1)C)[C@H]2O)OC)O)C)C)OC(=O)/C(=C\C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHertia cheirifolia Ref.
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