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1-BETA,3-BETA,18-O,O,O-TRIACETYLMANOYL_OXIDE

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1-BETA,3-BETA,18-O,O,O-TRIACETYLMANOYL_OXIDE
SpectraBase Compound ID 4FyNE8io7rW
InChI InChI=1S/C26H40O7/c1-9-23(5)12-10-20-25(7,33-23)13-11-19-24(6,15-30-16(2)27)21(31-17(3)28)14-22(26(19,20)8)32-18(4)29/h9,19-22H,1,10-15H2,2-8H3/t19-,20-,21-,22+,23-,24-,25+,26-/m0/s1
InChIKey UPONRAJXRCGVKJ-JULRNPMSSA-N
Mol Weight 464.6 g/mol
Molecular Formula C26H40O7
Exact Mass 464.277404 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DkfBPXftYmI
Name 1-BETA,3-BETA,18-O,O,O-TRIACETYLMANOYL_OXIDE
Compound Number 14A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H40O7
InChI InChI=1S/C26H40O7/c1-9-23(5)12-10-20-25(7,33-23)13-11-19-24(6,15-30-16(2)27)21(31-17(3)28)14-22(26(19,20)8)32-18(4)29/h9,19-22H,1,10-15H2,2-8H3/t19-,20-,21-,22+,23-,24-,25+,26-/m0/s1
InChIKey UPONRAJXRCGVKJ-JULRNPMSSA-N
Literature Reference Author B.M.FRAGA,P.GONZALEZ,R.GUILLERMO,M.G.HERNANDEZ
Literature Reference Citation J.NAT.PROD.,61,1237(1998)
Literature Reference DOI 10.1021/np980133m
Molecular Weight 464.599 g/mol
Solvent CDCl3
Source File Reference UWMZ1395