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Azuleno[4,5-b]furan-2(3H)-one, 3,8-bis(acetyloxy)-3-[(acetyloxy)methyl]decahydro-9-methyl-6-methylen e-, [3R-(3.alpha.,3a.alpha.,6a.alpha.,8.beta.,9.alpha.,9a.alpha.,9b.beta.)]-
SpectraBase Compound ID 2EJGmENSEC
InChI InChI=1S/C21H28O8/c1-10-6-7-16-19(18-11(2)17(8-15(10)18)27-13(4)23)28-20(25)21(16,29-14(5)24)9-26-12(3)22/h11,15-19H,1,6-9H2,2-5H3/t11-,15+,16-,17+,18+,19+,21-/m0/s1
InChIKey ZTPDVPZZGCVBFM-OYZAFBFQSA-N
Mol Weight 408.45 g/mol
Molecular Formula C21H28O8
Exact Mass 408.178418 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A5cQeHxOio3
Name Azuleno[4,5-b]furan-2(3H)-one, 3,8-bis(acetyloxy)-3-[(acetyloxy)methyl]decahydro-9-methyl-6-methylen e-, [3R-(3.alpha.,3a.alpha.,6a.alpha.,8.beta.,9.alpha.,9a.alpha.,9b.beta.)]-
Alternate Name(s) (3R,3aS,6aS,8R,9R,9aS,9bS)-3-(acetyloxy)-3-[(acetyloxy)methyl]-9-methyl-6-methylene-2-oxododecahydroazuleno[4,5-b]furan-8-yl acetate 3,11,13-Triacetylcynaratriol
CAS Registry Number 70894-21-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O8
InChI InChI=1S/C21H28O8/c1-10-6-7-16-19(18-11(2)17(8-15(10)18)27-13(4)23)28-20(25)21(16,29-14(5)24)9-26-12(3)22/h11,15-19H,1,6-9H2,2-5H3/t11-,15+,16-,17+,18+,19+,21-/m0/s1
InChIKey ZTPDVPZZGCVBFM-OYZAFBFQSA-N
Molecular Weight 408.447 g/mol
SMILES [C@@]1(C(O[C@@]2([C@@]1(CCC(=C)[C@@]1([C@]2([C@]([C@](OC(=O)C)(C1)[H])(C)[H])[H])[H])[H])[H])=O)(OC(=O)C)COC(=O)C
SPLASH splash10-054k-0960000000-f75c8f34c047f230c6f9
Source of Spectrum H-62-1293-1
Wiley ID 1372870