input word = C00013181

Metabolite InformationStructural formula
Name Eumaitenin
[3R-(3alpha,4alpha,5beta,5aalpha,6alpha,9alpha,9aalpha,10R*)]-4,6,10-tris(Acetyloxy)octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester 3-furancarboxylic acid
Formula C26H34O10
Mw 506.21519731
CAS RN 112516-44-6
C_ID C00013181 ,
InChIKey ROIYJZDYULCGCZ-UHFFFAOYNA-N
InChICode InChI=1S/C26H34O10/c1-13-8-9-18(32-14(2)27)25(7)22(35-23(30)17-10-11-31-12-17)20(33-15(3)28)19-21(34-16(4)29)26(13,25)36-24(19,5)6/h10-13,18-22H,8-9H2,1-7H3/t13-,18+,19+,20-,21+,22+,25+,26+/m1/s1
SMILES [C@@H]12[C@H]([C@@H]([C@]3([C@@]([C@@H](CC[C@@H]3OC(=O)C)C)(OC1(C)C)[C@H]2OC(=O)C)C)OC(=O)c1cocc1)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeMaytenus boaria Ref.
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