SpectraBase Compound ID | B8WfpsyP9OW |
---|---|
InChI | InChI=1S/2C37H66O7.Ca/c2*1-3-4-5-15-19-30(38)20-17-22-32(40)34-24-26-36(44-34)35-25-23-33(43-35)31(39)21-16-13-11-9-7-6-8-10-12-14-18-29-27-28(2)42-37(29)41;/h2*27-28,30-36,38-40H,3-26H2,1-2H3;/q;;+2/t28-,30?,31+,32-,33-,34+,35-,36+;28-,30?,31-,32+,33-,34+,35-,36+;/m10./s1 |
InChIKey | AVSSEBQDMUIDJQ-SOLGDFNUSA-N |
Mol Weight | 1285.9 g/mol |
Molecular Formula | C74H132CaO14 |
Exact Mass | 1284.9243 g/mol |
Parent InChIKey | DAEFUOXKPZLQMM-OMMVZGQDSA-N |
Enantiomer InChIKey | AVSSEBQDMUIDJQ-XBMMTGSZSA-N |
Title | Journal or Book | Year |
---|---|---|
NMR Studies of Ca2+ Complexes of Annonaceous Acetogenins | The Journal of Organic Chemistry | 1997 |
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