input word = C00012868

Metabolite InformationStructural formula
Name Subcordatolide C
[3aR-(3aalpha,4alpha,4aalpha,8beta,8abeta,9aalpha)]-Dodecahydro-8-hydroxy-8a-methyl-3,5-bis(methylene)-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-propanoic acid
Formula C19H26O5
Mw 334.17802394
CAS RN 95732-44-8
C_ID C00012868 ,
InChIKey GEAKLPVKLKYFLZ-OOVYAYRKNA-N
InChICode InChI=1S/C19H26O5/c1-9(2)17(21)24-16-14-11(4)18(22)23-12(14)8-19(5)13(20)7-6-10(3)15(16)19/h9,12-16,20H,3-4,6-8H2,1-2,5H3/t12-,13-,14+,15-,16+,19+/m1/s1
SMILES C1(=C)[C@H]2[C@]([C@@H](CC1)O)(C[C@@H]1[C@@H]([C@@H]2OC(=O)C(C)C)C(=C)C(=O)O1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCalea subcordata Ref.
PlantaeBoraginaceaeCordia subcordata Ref.
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OrganismCalea subcordata
ReferenceOber,Phytochem.,23,(1984),1289