14-Oxabicyclo[11.2.1]hexadecane, propanedioic acid deriv.

SpectraBase Compound ID	LkoAYSOuGte
InChI	InChI=1S/C23H34O6/c1-16-6-4-7-17(14-24)8-5-9-18(15-28-22(27)13-21(25)26)20-12-19(11-10-16)23(2,3)29-20/h6,8,14,18-20H,4-5,7,9-13,15H2,1-3H3,(H,25,26)/b16-6-,17-8+/t18-,19+,20-/m0/s1
InChIKey	AMYIYXBGBJBWSI-PVEPIOCWSA-N Google Search
Mol Weight	406.5 g/mol
Molecular Formula	C23H34O6
Exact Mass	406.235539 g/mol

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SpectraBase Spectrum ID	ECadogykA1E
Name	14-Oxabicyclo[11.2.1]hexadecane, propanedioic acid deriv.
Alternate Name(s)	Propanedioic acid, mono[(8-formyl-4,15,15-trimethyl-14-oxabicyclo[11.2.1]hexadeca-4,8-dien-12-yl)methyl]ester, [1R-(1R,4Z,8E,12S,13S*)]- 3-{[(1R,12S,13S)-8-formyl-4,15,15-trimethyl-14-oxabicyclo[11.2.1]hexadeca-4,8-dien-12-yl]methoxy}-3-oxopropanoic acid 4,15,15-Trimethyl-8-formyl-12-[(hydroxycarbonyl)acetoxymethyl]-16-oxatricylo[11.1.2]hexadeca-4,8-diene
CAS Registry Number	105608-41-1
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C23H34O6
InChI	InChI=1S/C23H34O6/c1-16-6-4-7-17(14-24)8-5-9-18(15-28-22(27)13-21(25)26)20-12-19(11-10-16)23(2,3)29-20/h6,8,14,18-20H,4-5,7,9-13,15H2,1-3H3,(H,25,26)/b16-6-,17-8+/t18-,19+,20-/m0/s1
InChIKey	AMYIYXBGBJBWSI-PVEPIOCWSA-N
Molecular Weight	406.519 g/mol
SMILES	OC(CC(OC[C@]1([C@]2(OC([C@@](CC\C(=C/CC\C(=C/CC1)C=O)C)([H])C2)(C)C)[H])[H])=O)=O
SPLASH	splash10-05aj-7900000000-3f5f9529fcd031bdfe46
Source of Spectrum	B-39-1709-15
Wiley ID	1372209