4H-1,3-Dioxolo[4,5-c]pyran, nonanoic acid deriv.

SpectraBase Compound ID	IQiTwxBdjpL
InChI	InChI=1S/C30H50O8/c1-7-21(3)27-24(36-27)18-22-19-35-23(29-28(22)37-30(4,5)38-29)16-20(2)17-26(32)34-15-13-11-9-8-10-12-14-25(31)33-6/h17,21-24,27-29H,7-16,18-19H2,1-6H3/b20-17+/t21?,22-,23-,24+,27+,28+,29-/m1/s1
InChIKey	NEXBQBGWVCRMBO-VOPLADHKSA-N Google Search
Mol Weight	538.7 g/mol
Molecular Formula	C30H50O8
Exact Mass	538.350569 g/mol

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SpectraBase Spectrum ID	JQJsKQKH6yA
Name	4H-1,3-Dioxolo[4,5-c]pyran, nonanoic acid deriv.
Alternate Name(s)	Nonanoic acid, 9-[[3-methyl-1-oxo-4-[tetrahydro-2,2-dimethyl-7-[[3-(1-methylpropyl)oxiranyl]methyl]-4H-1,3-dioxolo[4,5-c]pyran-4-yl]-2-butenyl]oxy]-, methyl ester, [3aR-[3a.alpha.,4.alpha.(E),7.alpha.[2S,3S(S*)],7a.alpha.]]- 13-Deoxymonate 9-Methoxy-9-oxononyl (2E)-5,9-anhydro-8-{[(2S,3S)-3-sec-butyloxiranyl]methyl}-2,3,4,8-tetradeoxy-3-methyl-6,7-O-(1-methylethylidene)-D-talo-non-2-enonate
CAS Registry Number	112615-47-1
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C30H50O8
InChI	InChI=1S/C30H50O8/c1-7-21(3)27-24(36-27)18-22-19-35-23(29-28(22)37-30(4,5)38-29)16-20(2)17-26(32)34-15-13-11-9-8-10-12-14-25(31)33-6/h17,21-24,27-29H,7-16,18-19H2,1-6H3/b20-17+/t21?,22-,23-,24+,27+,28+,29-/m1/s1
InChIKey	NEXBQBGWVCRMBO-VOPLADHKSA-N
Molecular Weight	538.722 g/mol
SMILES	[C@@]1(O[C@]1(C(CC)C)[H])(C[C@]1([C@]2([C@@](OC(O2)(C)C)([H])[C@](OC1)(C\C(=C\C(=O)OCCCCCCCCC(=O)OC)C)[H])[H])[H])[H]
SPLASH	splash10-03dl-0590000000-059d472e4b7e57947532
Source of Spectrum	F-43-2169-1
Wiley ID	1404348