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Propanoic acid, 2-methyl-, 6-formyl-2,3,3a,4,5,8,9,10,11,11a-decahydro-9-hydroxy-3-(methoxymethyl)-10-methyl-2-oxocyclodeca[b]furan-4-yl ester
SpectraBase Compound ID FUkxL4klK34
InChI InChI=1S/C20H30O7/c1-11(2)19(23)26-17-8-13(9-21)5-6-15(22)12(3)7-16-18(17)14(10-25-4)20(24)27-16/h5,9,11-12,14-18,22H,6-8,10H2,1-4H3/b13-5+
InChIKey IDJQJHMGZRERLS-WLRTZDKTSA-N
Mol Weight 382.45 g/mol
Molecular Formula C20H30O7
Exact Mass 382.199153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A3n3S5SSzFp
Name Propanoic acid, 2-methyl-, 6-formyl-2,3,3a,4,5,8,9,10,11,11a-decahydro-9-hydroxy-3-(methoxymethyl)-10-methyl-2-oxocyclodeca[b]furan-4-yl ester
CAS Registry Number 88555-99-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O7
InChI InChI=1S/C20H30O7/c1-11(2)19(23)26-17-8-13(9-21)5-6-15(22)12(3)7-16-18(17)14(10-25-4)20(24)27-16/h5,9,11-12,14-18,22H,6-8,10H2,1-4H3/b13-5+
InChIKey IDJQJHMGZRERLS-WLRTZDKTSA-N
Molecular Weight 382.453 g/mol
SMILES OC1C(CC2OC(C(C2C(OC(=O)C(C)C)C\C(=C/C1)C=O)COC)=O)C
SPLASH splash10-00fr-9072000000-5744e4fcc0a63ac24401
Source of Spectrum F-39-2845-0
Synonyms 6-formyl-9-hydroxy-3-(methoxymethyl)-10-methyl-2-oxo-2,3,3a,4,5,8,9,10,11,11a-decahydrocyclodeca[b]furan-4-yl 2-methylpropanoate Cyclodeca[b]furan, propanoic acid deriv. Methoxy, formyl, dideoxy derivative of Tetrahydrotagitinin A
Wiley ID 1360506