input word = C00017344

Metabolite InformationStructural formula
Name [4aS-[4aalpha,5alpha,6beta,7alpha(Z),8abeta]]-4,4a,5,6,7,8,8a,9-octahydro-3,4a,5-trimethyl-6-[(3-methyl-1-oxo-2-butenyl)oxy]naphtho[2,3-b]furan-7-yl ester 2-methyl-2-butenoic acid
Formula C25H34O5
Mw 414.2406242
CAS RN 54878-88-5
C_ID C00017344 ,
InChIKey IDAAXBSMDRZVPD-ILERWSCDNA-N
InChICode InChI=1S/C25H34O5/c1-8-15(4)24(27)29-21-11-18-10-20-19(16(5)13-28-20)12-25(18,7)17(6)23(21)30-22(26)9-14(2)3/h8-9,13,17-18,21,23H,10-12H2,1-7H3/b15-8-/t17-,18+,21-,23-,25-/m0/s1
SMILES [C@H]1([C@H]([C@@H]([C@]2([C@@H](C1)Cc1c(C2)c(co1)C)C)C)OC(=O)C=C(C)C)OC(=O)/C(=C\C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeOthonna spp. Ref.
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