1-Acetyltagitinin A
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1-Acetyltagitinin A

CAS 60547-63-9
Synonyms Propanoic acid, 2-methyl-, (3aS,4R,6R,7R,9S,10S,11aR)-7-(acetyloxy)dodecahydro-9-hydroxy-6,10-dimethyl-3-methylene-2-oxo-6,9-epoxycyclodeca[b]furan-4-yl ester
IUPAC Name (12-Acetyloxy-1-hydroxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.04,8]tetradecan-9-yl) 2-methylpropanoate
Molecular Weight 410.46
Molecular Formula C21H30O8
Canonical SMILES CC1CC2C(C(CC3(C(CC1(O3)O)OC(=O)C)C)OC(=O)C(C)C)C(=C)C(=O)O2
InChI InChI=1S/C21H30O8/c1-10(2)18(23)28-15-8-20(6)16(26-13(5)22)9-21(25,29-20)11(3)7-14-17(15)12(4)19(24)27-14/h10-11,14-17,25H,4,7-9H2,1-3,5-6H3
InChI Key MFYNTWZAYXDJQB-UHFFFAOYSA-N
Purity 98%
Appearance Solid

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