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(2R,3R,3aR)-2-(4,5-Bis-benzyloxymethyl-2-methyl-[1,3]dioxolan-2-yl)-hexahydro-isoxazolo[2,3-a]pyridine-3-carboxylic acid methyl ester
SpectraBase Compound ID 95bAZYzvmi9
InChI InChI=1S/C29H37NO7/c1-29(27-26(28(31)32-2)23-15-9-10-16-30(23)37-27)35-24(19-33-17-21-11-5-3-6-12-21)25(36-29)20-34-18-22-13-7-4-8-14-22/h3-8,11-14,23-27H,9-10,15-20H2,1-2H3/t23-,24?,25?,26-,27-,29?/m1/s1
InChIKey YZBOJANHIJMCBC-NZXWUETHSA-N
Mol Weight 511.6 g/mol
Molecular Formula C29H37NO7
Exact Mass 511.257003 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4jjYgSzCoxy
Name (2R,3R,3aR)-2-(4,5-Bis-benzyloxymethyl-2-methyl-[1,3]dioxolan-2-yl)-hexahydro-isoxazolo[2,3-a]pyridine-3-carboxylic acid methyl ester
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Formula C29H37NO7
InChI InChI=1S/C29H37NO7/c1-29(27-26(28(31)32-2)23-15-9-10-16-30(23)37-27)35-24(19-33-17-21-11-5-3-6-12-21)25(36-29)20-34-18-22-13-7-4-8-14-22/h3-8,11-14,23-27H,9-10,15-20H2,1-2H3/t23-,24?,25?,26-,27-,29?/m1/s1
InChIKey YZBOJANHIJMCBC-NZXWUETHSA-N
Molecular Weight 511.615 g/mol
SMILES [C@@]1(C2(OC(COCc3ccccc3)C(O2)COCc2ccccc2)C)([C@@]([C@]2(CCCCN2O1)[H])(C(=O)OC)[H])[H]
SPLASH splash10-0006-9000000000-8749ae66471cd492a0e5
Source of Spectrum KD-12-1755-22
Synonyms exo-Methyl (2R,3R,3aR/S)-2-[1,1-[(2S,3S)-1,4-dibenzyloxy-2,3-butylenedioxy]ethyl]hexahydro-2H-isoxazolo[2,3-a]pyridine-3-carboxylate Methyl (2R,3R,3aR)-2-{4,5-bis[(benzyloxy)methyl]-2-methyl-1,3-dioxolan-2-yl}hexahydro-2H-isoxazolo[2,3-a]pyridine-3-carboxylate
Wiley ID 1634523