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Methyl 5-([6-(acetyloxy)-5-(3-hydroxy-3-methylbutyl)-5,8a-dimethyl-2-methylenedecahydro-1-naphthalenyl]methyl)-6-methoxy-2-methyl-4-oxo-4H-pyran-3-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl 5-([6-(acetyloxy)-5-(3-hydroxy-3-methylbutyl)-5,8a-dimethyl-2-methylenedecahydro-1-naphthalenyl]methyl)-6-methoxy-2-methyl-4-oxo-4H-pyran-3-carboxylate
SpectraBase Compound ID LB1n9MhAuiB
InChI InChI=1S/C30H44O8/c1-17-10-11-22-29(6,13-12-23(38-19(3)31)30(22,7)15-14-28(4,5)34)21(17)16-20-25(32)24(26(33)35-8)18(2)37-27(20)36-9/h21-23,34H,1,10-16H2,2-9H3
InChIKey IIALGXOEPPIMPV-UHFFFAOYSA-N
Mol Weight 532.7 g/mol
Molecular Formula C30H44O8
Exact Mass 532.303618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9gQgTjXq3WJ
Name Methyl 5-([6-(acetyloxy)-5-(3-hydroxy-3-methylbutyl)-5,8a-dimethyl-2-methylenedecahydro-1-naphthalenyl]methyl)-6-methoxy-2-methyl-4-oxo-4H-pyran-3-carboxylate
Alternate Name(s) 4H-Pyran-3-carboxylic acid, 5-[[6-(acetyloxy)decahydro-5-(3-hydroxy-3-methylbutyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl]methyl]-6-methoxy-2-methyl-4-oxo-, methyl ester, (1.alpha.,4a.alpha.,5.alpha.,6.alpha.,8a.beta.)- 5-[[6-acetoxy-5-(3-hydroxy-3-methyl-butyl)-5,8a-dimethyl-2-methylene-decalin-1-yl]methyl]-4-keto-6-methoxy-2-methyl-pyran-3-carboxylic acid methyl ester 5-[[6-acetyloxy-5-(3-hydroxy-3-methylbutyl)-5,8a-dimethyl-2-methylene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methyl]-6-methoxy-2-methyl-4-oxo-3-pyrancarboxylic acid methyl ester Methyl 5-[[6-acetoxy-5-(3-hydroxy-3-methyl-butyl)-5,8a-dimethyl-2-methylene-decalin-1-yl]methyl]-6-methoxy-2-methyl-4-oxo-pyran-3-carboxylate Methyl 5-[[6-acetyloxy-5,8a-dimethyl-2-methylidene-5-(3-methyl-3-oxidanyl-butyl)-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methyl]-6-methoxy-2-methyl-4-oxidanylidene-pyran-3-carboxylate Methyl 5-[[6-acetyloxy-5-(3-hydroxy-3-methylbutyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methyl]-6-methoxy-2-methyl-4-oxopyran-3-carboxylate
CAS Registry Number 61228-72-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H44O8
InChI InChI=1S/C30H44O8/c1-17-10-11-22-29(6,13-12-23(38-19(3)31)30(22,7)15-14-28(4,5)34)21(17)16-20-25(32)24(26(33)35-8)18(2)37-27(20)36-9/h21-23,34H,1,10-16H2,2-9H3
InChIKey IIALGXOEPPIMPV-UHFFFAOYSA-N
Molecular Weight 532.674 g/mol
SMILES OC(C)(C)CCC1(C2CCC(=C)C(C2(CCC1OC(C)=O)C)CC=1C(C(=C(C)OC1OC)C(=O)OC)=O)C
SPLASH splash10-03di-6790240000-b5a144aa9af76e441dc6
Source of Spectrum W5-38165-27371-27371
Wiley ID 1403616