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HALOPHILOL_B

View entire compound with spectra: 1 NMR

HALOPHILOL_B
SpectraBase Compound ID 9Jo4YjXTQCG
InChI InChI=1S/C56H42O12/c57-35-10-4-29(5-11-35)54-50(33-19-38(60)23-39(61)20-33)49-32(18-42(64)26-47(49)67-54)3-1-28-2-16-46-44(17-28)52(56(66-46)31-8-14-37(59)15-9-31)45-25-43(65)27-48-53(45)51(34-21-40(62)24-41(63)22-34)55(68-48)30-6-12-36(58)13-7-30/h1-27,50-52,54-65H/b3-1-/t50-,51+,52-,54+,55-,56+/m1/s1
InChIKey WZKKRZSJTLGPHH-QXWNGRKOSA-N
Mol Weight 906.9 g/mol
Molecular Formula C56H42O12
Exact Mass 906.267627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KYIcogEaC1J
Name HALOPHILOL_B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H42O12
InChI InChI=1S/C56H42O12/c57-35-10-4-29(5-11-35)54-50(33-19-38(60)23-39(61)20-33)49-32(18-42(64)26-47(49)67-54)3-1-28-2-16-46-44(17-28)52(56(66-46)31-8-14-37(59)15-9-31)45-25-43(65)27-48-53(45)51(34-21-40(62)24-41(63)22-34)55(68-48)30-6-12-36(58)13-7-30/h1-27,50-52,54-65H/b3-1-/t50-,51+,52-,54+,55-,56+/m1/s1
InChIKey WZKKRZSJTLGPHH-QXWNGRKOSA-N
Literature Reference Author Y.WANG,J.TAN,C.TAN,S.JIANG,D.ZHU
Literature Reference Citation PLANTA.MED.,69,779(2003)
Literature Reference DOI 10.1055/s-2003-42792
Molecular Weight 906.942 g/mol
Solvent ACETONE-D6
Source File Reference UIAP2006