(2S,4aR,6S,8aS)-2-[(1S,5S)-4-benzoyloxy-1-hydroxy-1-methylpentyl]octahydro-6,8a-dimethylpyrano[3,2-b]pyran

SpectraBase Compound ID	Bzqcn7ML7VC
InChI	InChI=1S/C23H34O5/c1-16-13-15-23(4)20(26-16)11-10-19(28-23)22(3,25)14-12-17(2)27-21(24)18-8-6-5-7-9-18/h5-9,16-17,19-20,25H,10-15H2,1-4H3/t16-,17?,19-,20+,22-,23-/m0/s1
InChIKey	MLDBNKRRTCGRNW-MDOSDYSOSA-N Google Search
Mol Weight	390.5 g/mol
Molecular Formula	C23H34O5
Exact Mass	390.240624 g/mol

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SpectraBase Spectrum ID	HMzJD7YDVga
Name	(2S,4aR,6S,8aS)-2-[(1S,5S)-4-benzoyloxy-1-hydroxy-1-methylpentyl]octahydro-6,8a-dimethylpyrano[3,2-b]pyran
Alternate Name(s)	(5S)-5-[(2S,4aR,6S,8aS)-6,8a-dimethyl-octahydropyrano[3,2-b]pyran-2-yl]-5-hydroxyhexan-2-yl benzoate
CAS Registry Number	128300-91-4
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C23H34O5
InChI	InChI=1S/C23H34O5/c1-16-13-15-23(4)20(26-16)11-10-19(28-23)22(3,25)14-12-17(2)27-21(24)18-8-6-5-7-9-18/h5-9,16-17,19-20,25H,10-15H2,1-4H3/t16-,17?,19-,20+,22-,23-/m0/s1
InChIKey	MLDBNKRRTCGRNW-MDOSDYSOSA-N
Molecular Weight	390.520 g/mol
SMILES	O[C@]([C@]1(O[C@@]2([C@](O[C@](CC2)(C)[H])(CC1)[H])C)[H])(CCC(OC(=O)c1ccccc1)C)C
SPLASH	splash10-0002-9200000000-06da0cfa29da8a29d332
Source of Spectrum	J-55-5097-25
Wiley ID	1364986