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BUTYROLACTOL-A

View entire compound with spectra: 1 NMR

BUTYROLACTOL-A
SpectraBase Compound ID 9yZ3uXAC7m4
InChI InChI=1S/C28H46O9/c1-18(16-14-12-10-8-6-5-7-9-11-13-15-17-28(2,3)4)19(29)20(30)21(31)22(32)23(33)26-24(34)25(35)27(36)37-26/h7-14,18-26,29-35H,5-6,15-17H2,1-4H3/b9-7-,10-8+,13-11+,14-12+
InChIKey YHNIVBVCOOBXOO-FEECMKHQSA-N
Mol Weight 526.7 g/mol
Molecular Formula C28H46O9
Exact Mass 526.314183 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 68ctI5KjdlN
Name BUTYROLACTOL-A
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H46O9
InChI InChI=1S/C28H46O9/c1-18(16-14-12-10-8-6-5-7-9-11-13-15-17-28(2,3)4)19(29)20(30)21(31)22(32)23(33)26-24(34)25(35)27(36)37-26/h7-14,18-26,29-35H,5-6,15-17H2,1-4H3/b9-7-,10-8+,13-11+,14-12+
InChIKey YHNIVBVCOOBXOO-FEECMKHQSA-N
Literature Reference Author C.KOTAKE,T.YAMASAKI,T.MORIYAMA,M.SHINODA,N.KOMIYAMA,T.FURUMA I,M.KONISHI,T.OKI
Literature Reference Citation J.ANTIBIOTICS,45,1442(1992)
Literature Reference DOI 10.7164/antibiotics.45.1442
Molecular Weight 526.668 g/mol
Sample ID 45953
Solvent DMSO-D6