input word = C00013060

Metabolite InformationStructural formula
Name (+)-Artegallin
Artegallin
[3R-(3alpha,3abeta,5aalpha,6beta,9balpha)]-6-(Acetyloxy)-3a,5,5a,6,7,9b-hexahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione
Formula C17H22O5
Mw 306.14672381
CAS RN 104720-09-4
C_ID C00013060 ,
InChIKey UIOWPVNQQYCUNQ-CDBZLCIQNA-N
InChICode InChI=1S/C17H22O5/c1-8-11-5-6-17(4)13(21-10(3)18)7-12(19)9(2)14(17)15(11)22-16(8)20/h8,11,13,15H,5-7H2,1-4H3/t8-,11+,13+,15+,17+/m1/s1
SMILES [C@@]12(C(=C(C(=O)C[C@@H]2OC(=O)C)C)[C@@H]2[C@@H](CC1)[C@H](C(=O)O2)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArtemisia caerulescens subsp. Gallica Ref.
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