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Cyclopenta[c]pyran-4-carboxaldehyde, 1,4a,5,6,7,7a-hexahydro-7-methyl-1-[(2,3,4,6-tetra-O-acetyl-.beta.-D- glucopyranosyl)oxy]-, [1S-(1.alpha.,4a.alpha.,7.beta.,7a.alpha.)]-
SpectraBase Compound ID 6hqRBGnxv1J
InChI InChI=1S/C24H32O12/c1-11-6-7-17-16(8-25)9-31-23(19(11)17)36-24-22(34-15(5)29)21(33-14(4)28)20(32-13(3)27)18(35-24)10-30-12(2)26/h8-9,11,17-24H,6-7,10H2,1-5H3/t11-,17-,18+,19-,20+,21-,22+,23+,24-/m0/s1
InChIKey GYFRNAKMZGGGJO-QTNJVECVSA-N
Mol Weight 512.5 g/mol
Molecular Formula C24H32O12
Exact Mass 512.189376 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9MeS1X8M5ka
Name Cyclopenta[c]pyran-4-carboxaldehyde, 1,4a,5,6,7,7a-hexahydro-7-methyl-1-[(2,3,4,6-tetra-O-acetyl-.beta.-D- glucopyranosyl)oxy]-, [1S-(1.alpha.,4a.alpha.,7.beta.,7a.alpha.)]-
Alternate Name(s) (1R,4aR,7S,7aS)-4-formyl-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl 2,3,4,6-tetra-O-acetyl-.beta.-D-glucopyranoside Boschnaloside tetraacetate O,O',O'',O'''-tetraacetyl-boschnalside O,O',O'',O'''-Tetraacetyl-boschnalside
CAS Registry Number 72963-60-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H32O12
InChI InChI=1S/C24H32O12/c1-11-6-7-17-16(8-25)9-31-23(19(11)17)36-24-22(34-15(5)29)21(33-14(4)28)20(32-13(3)27)18(35-24)10-30-12(2)26/h8-9,11,17-24H,6-7,10H2,1-5H3/t11-,17-,18+,19-,20+,21-,22+,23+,24-/m0/s1
InChIKey GYFRNAKMZGGGJO-QTNJVECVSA-N
Molecular Weight 512.508 g/mol
SMILES [C@@]1([C@]([C@](OC(=O)C)([C@](O[C@]1(O[C@@]1([C@@]2([C@](CC[C@@]2(C)[H])([H])C(=CO1)C=O)[H])[H])[H])(COC(=O)C)[H])[H])(OC(=O)C)[H])(OC(=O)C)[H]
SPLASH splash10-066r-2900000000-96aca16fabeda1f21f90
Source of Spectrum H-62-2711-0
Wiley ID 1400749