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(3aR)-[5-(1,1'-Biphenyl-4-carbonyloxy)-hexahydro-2H-cyclopenta[b]furan-2-on-4-yl]methyl hydrogen pentanedioate
SpectraBase Compound ID DEJLB0l2K3v
InChI InChI=1S/C26H26O8/c27-23(28)7-4-8-24(29)32-15-20-19-13-25(30)33-21(19)14-22(20)34-26(31)18-11-9-17(10-12-18)16-5-2-1-3-6-16/h1-3,5-6,9-12,19-22H,4,7-8,13-15H2,(H,27,28)/t19-,20?,21?,22?/m1/s1
InChIKey IMXQZHYPJADJKZ-AOFALMCMSA-N
Mol Weight 466.49 g/mol
Molecular Formula C26H26O8
Exact Mass 466.162768 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1LBCUAHDwWB
Name (3aR)-[5-(1,1'-Biphenyl-4-carbonyloxy)-hexahydro-2H-cyclopenta[b]furan-2-on-4-yl]methyl hydrogen pentanedioate
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Formula C26H26O8
InChI InChI=1S/C26H26O8/c27-23(28)7-4-8-24(29)32-15-20-19-13-25(30)33-21(19)14-22(20)34-26(31)18-11-9-17(10-12-18)16-5-2-1-3-6-16/h1-3,5-6,9-12,19-22H,4,7-8,13-15H2,(H,27,28)/t19-,20?,21?,22?/m1/s1
InChIKey IMXQZHYPJADJKZ-AOFALMCMSA-N
Molecular Weight 466.486 g/mol
SMILES OC(CCCC(OCC1[C@@]2(C(OC(=O)C2)CC1OC(c1ccc(cc1)-c1ccccc1)=O)[H])=O)=O
SPLASH splash10-001j-1900100000-d63436770d7978a5d425
Source of Spectrum G-56-1697-0
Synonyms 5-({(3aR)-5-[([1,1'-biphenyl]-4-ylcarbonyl)oxy]-2-oxohexahydro-2H-cyclopenta[b]furan-4-yl}methoxy)-5-oxopentanoic acid
Wiley ID 748275