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Ancistrocongoline A
SpectraBase Compound ID 2MZpfb3Fhdv
InChI InChI=1S/C24H27NO4/c1-12-8-16-15(6-7-18(26)24(16)21(9-12)29-5)23-17-10-13(2)25(4)14(3)22(17)19(27)11-20(23)28/h6-9,11,13-14,26-28H,10H2,1-5H3/t13-,14-/m1/s1
InChIKey GWJJRDKEDFSIDL-ZIAGYGMSSA-N
Mol Weight 393.48 g/mol
Molecular Formula C24H27NO4
Exact Mass 393.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HsERha2N5Ow
Name Ancistrocongoline A
Appearance Amorphous light brown powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H27NO4
InChI InChI=1S/C24H27NO4/c1-12-8-16-15(6-7-18(26)24(16)21(9-12)29-5)23-17-10-13(2)25(4)14(3)22(17)19(27)11-20(23)28/h6-9,11,13-14,26-28H,10H2,1-5H3/t13-,14-/m1/s1
InChIKey GWJJRDKEDFSIDL-ZIAGYGMSSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1021/np010622d
Molecular Weight 393.483 g/mol
Optical Rotation [a]D23 = +6.9 (c = 0.05, CHCl3)
Reported Formula C24H27NO4
SMILES Oc1ccc(-c2c3c(c(cc2O)O)[C@](N([C@@](C3)(C)[H])C)(C)[H])c2cc(cc(c12)OC)C
SPLASH splash10-004i-0009000000-77ded77d243ebf7defce
Source of Spectrum G4-65-1100-4
Wiley ID 1883784