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ORTHOSIPHONONE-B
SpectraBase Compound ID Ia40OHlV2nc
InChI InChI=1S/C38H42O11/c1-8-36(6)20-25(48-32(42)23-15-11-9-12-16-23)29-37(7)26(19-27(46-21(2)39)38(29,45)34(36)44)35(4,5)30(41)28(47-22(3)40)31(37)49-33(43)24-17-13-10-14-18-24/h8-18,25-29,31,45H,1,19-20H2,2-7H3/t25-,26+,27-,28+,29-,31+,36+,37+,38+/m1/s1
InChIKey DCFZKBTZZMFTED-ZHKQRIMUSA-N
Mol Weight 674.7 g/mol
Molecular Formula C38H42O11
Exact Mass 674.272712 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8uR2sCJebx6
Name ORTHOSIPHONONE-B
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H42O11
InChI InChI=1S/C38H42O11/c1-8-36(6)20-25(48-32(42)23-15-11-9-12-16-23)29-37(7)26(19-27(46-21(2)39)38(29,45)34(36)44)35(4,5)30(41)28(47-22(3)40)31(37)49-33(43)24-17-13-10-14-18-24/h8-18,25-29,31,45H,1,19-20H2,2-7H3/t25-,26+,27-,28+,29-,31+,36+,37+,38+/m1/s1
InChIKey DCFZKBTZZMFTED-ZHKQRIMUSA-N
Literature Reference Author H.SHIBUYA,T.BOHGAKI,T.MATSUBARA,M.WATARI,K.OHASHI,I.KITAGAWA
Literature Reference Citation CHEM.PHARM.BULL.,47,695(1999)
Literature Reference DOI 10.1248/cpb.47.695
Molecular Weight 674.745 g/mol
Solvent CDCl3
Source File Reference UWLU8011