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DICHAPETALIN-A;(4-ALPHA,6'-ALPHA,7-ALPHA,17-ALPHA,20S,23R,24E)-2',3',5',6'-TETRAHYDRO-7,23,26-TRIHYDROXY-6'-PHENYL-13,30-CYClO-29-NOR-DAMMARA-2,11,
SpectraBase Compound ID JqM5D1o30Ap
InChI InChI=1S/C38H48O5/c1-23(20-39)16-26-18-27(33(41)43-26)28-11-15-38-21-37(28,38)14-12-30-34(2)13-10-25-17-29(24-8-6-5-7-9-24)42-22-35(25,3)31(34)19-32(40)36(30,38)4/h5-10,12,14,16,26-32,39-40H,11,13,15,17-22H2,1-4H3/b23-16+/t26-,27-,28+,29+,30-,31-,32-,34-,35+,36+,37-,38-/m1/s1
InChIKey LRJFCTOUXFAGON-RTHPPHIYSA-N
Mol Weight 584.8 g/mol
Molecular Formula C38H48O5
Exact Mass 584.350175 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1AF75zVqBnd
Name DICHAPETALIN-A;(4-ALPHA,6'-ALPHA,7-ALPHA,17-ALPHA,20S,23R,24E)-2',3',5',6'-TETRAHYDRO-7,23,26-TRIHYDROXY-6'-PHENYL-13,30-CYClO-29-NOR-DAMMARA-2,11,
Compound Number 1
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H48O5
InChI InChI=1S/C38H48O5/c1-23(20-39)16-26-18-27(33(41)43-26)28-11-15-38-21-37(28,38)14-12-30-34(2)13-10-25-17-29(24-8-6-5-7-9-24)42-22-35(25,3)31(34)19-32(40)36(30,38)4/h5-10,12,14,16,26-32,39-40H,11,13,15,17-22H2,1-4H3/b23-16+/t26-,27-,28+,29+,30-,31-,32-,34-,35+,36+,37-,38-/m1/s1
InChIKey LRJFCTOUXFAGON-RTHPPHIYSA-N
Literature Reference Author I.ADDAE-MENSAH,R.WAIBEL,S.A.ASUNKA,I.V.OPPONG,H.ACHENBACH
Literature Reference Citation PHYTOCHEM.,43,649(1996)
Literature Reference DOI 10.1016/0031-9422(96)00350-0
Molecular Weight 584.796 g/mol
Solvent CDCl3
Source File Reference UWMS2115