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(1S*,2S*,3S*)-1-(3-Methoxy-4-benzyloxybenzyl)-2-hydroxymethyl-3-hydroxy-6-methoxy-7-benzyloxytetralin-3-carboxylic acid lactone

View entire compound with spectra: 1 MS (GC)

(1S*,2S*,3S*)-1-(3-Methoxy-4-benzyloxybenzyl)-2-hydroxymethyl-3-hydroxy-6-methoxy-7-benzyloxytetralin-3-carboxylic acid lactone
SpectraBase Compound ID ASx8hoxDdvb
InChI InChI=1S/C35H34O7/c1-38-31-16-25(13-14-30(31)40-20-23-9-5-3-6-10-23)15-28-27-18-33(41-21-24-11-7-4-8-12-24)32(39-2)17-26(27)19-35(37)29(28)22-42-34(35)36/h3-14,16-18,28-29,37H,15,19-22H2,1-2H3/t28-,29-,35+/m1/s1
InChIKey COICCLMIWMLQSL-KPNDNRKWSA-N
Mol Weight 566.7 g/mol
Molecular Formula C35H34O7
Exact Mass 566.230453 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J2NMI9La3Jm
Name (1S*,2S*,3S*)-1-(3-Methoxy-4-benzyloxybenzyl)-2-hydroxymethyl-3-hydroxy-6-methoxy-7-benzyloxytetralin-3-carboxylic acid lactone
Alternate Name(s) (3aS,4S,9aS)-6-Benzyloxy-4-(4-benzyloxy-3-methoxy-benzyl)-9a-hydroxy-7-methoxy-3a,4,9,9a-tetrahydro-3H-naphtho[2,3-c]furan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H34O7
InChI InChI=1S/C35H34O7/c1-38-31-16-25(13-14-30(31)40-20-23-9-5-3-6-10-23)15-28-27-18-33(41-21-24-11-7-4-8-12-24)32(39-2)17-26(27)19-35(37)29(28)22-42-34(35)36/h3-14,16-18,28-29,37H,15,19-22H2,1-2H3/t28-,29-,35+/m1/s1
InChIKey COICCLMIWMLQSL-KPNDNRKWSA-N
Molecular Weight 566.650 g/mol
SMILES O[C@]12[C@@]([C@@](c3cc(OCc4ccccc4)c(cc3C1)OC)(Cc1cc(OC)c(cc1)OCc1ccccc1)[H])(COC2=O)[H]
SPLASH splash10-0006-9000010000-d9e391515bf9ddc2d0f5
Source of Spectrum PS-0-2752-2
Wiley ID 786831