input word = C00012983

Metabolite InformationStructural formula
Name Arturin
[3aR-[3aalpha,4beta(Z),5abeta,6beta,9aalpha,9bbeta]]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid
Formula C20H26O5
Mw 346.17802394
CAS RN 78012-26-7
C_ID C00012983 ,
InChIKey FDDKULNHLFGRDK-KFUBDDQRNA-N
InChICode InChI=1S/C20H26O5/c1-6-10(2)18(22)24-13-9-20(5)14(21)8-7-11(3)16(20)17-15(13)12(4)19(23)25-17/h6,13-17,21H,3-4,7-9H2,1-2,5H3/b10-6-/t13-,14-,15-,16-,17+,20+/m1/s1
SMILES [C@@H]1([C@]2([C@H](C(=C)CC1)[C@@H]1[C@@H]([C@@H](C2)OC(=O)/C(=C\C)/C)C(=C)C(=O)O1)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaePodanthus mitiqui Ref.
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