John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=1IbApG2lOa3

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ALPHA-ERGOKRYPTINE
SpectraBase Compound ID 1IbApG2lOa3
InChI InChI=1S/C32H41N5O5/c1-17(2)12-25-29(39)36-11-7-10-26(36)32(41)37(25)30(40)31(42-32,18(3)4)34-28(38)20-13-22-21-8-6-9-23-27(21)19(15-33-23)14-24(22)35(5)16-20/h6,8-9,13,15,17-18,20,24-26,33,41H,7,10-12,14,16H2,1-5H3,(H,34,38)/t20-,24?,25+,26+,31-,32+/m1/s1
InChIKey YDOTUXAWKBPQJW-VQWCOIGNSA-N
Mol Weight 575.7 g/mol
Molecular Formula C32H41N5O5
Exact Mass 575.31077 g/mol
Enantiomer InChIKey YDOTUXAWKBPQJW-WJCCATOGSA-N
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Solvent CDCl3
Title Journal or Book Year
Two Unusual Ergopeptines Produced by a Saprophytic Culture of Claviceps purpurea Journal of Natural Products 1987
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