input word = C00013070

Metabolite InformationStructural formula
Name Gutenbergin
[3aS-(3aalpha,5beta,5abeta,9aalpha,9bbeta)]-5-(Acetyloxy)-3a,5,5a,9,9a,9b-hexahydro-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2,8(3H,4H)-dione
Formula C17H18O5
Mw 302.11542369
CAS RN 112356-36-2
C_ID C00013070 ,
InChIKey PLCJTUJOQJIDAC-RLSUFVFQNA-N
InChICode InChI=1S/C17H18O5/c1-8-11-7-13(21-10(3)18)17(4)6-5-12(19)9(2)14(17)15(11)22-16(8)20/h5-6,11,13-15H,1-2,7H2,3-4H3/t11-,13-,14+,15-,17-/m0/s1
SMILES C1=C[C@@]2([C@H](C(=C)C1=O)[C@@H]1[C@@H](C[C@@H]2OC(=O)C)C(=C)C(=O)O1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeGutenbergia cordifolia Ref.
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OrganismGutenbergia cordifolia
ReferenceFujimoto,Phytochem.,26,(1987),2593