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CAS 32222-75-6

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Ergoline-8-methanol, 10-methoxy-1,6-dimethyl-, 5-bromo-3-pyridinecarboxylate (ester), (8β)-, (2R,3R)-2,3-dihydroxybutanedioate (salt)

Description:
Ergoline-8-methanol, 10-methoxy-1,6-dimethyl-, 5-bromo-3-pyridinecarboxylate (ester), (8β)-, (2R,3R)-2,3-dihydroxybutanedioate (salt) is a complex organic compound characterized by its ergoline backbone, which is a structure commonly associated with various alkaloids. This compound features multiple functional groups, including methoxy, bromo, and carboxylate moieties, contributing to its potential biological activity. The presence of the pyridine ring suggests possible interactions with biological systems, particularly in receptor binding or enzyme inhibition. The dihydroxybutanedioate component indicates that the compound may exhibit solubility in polar solvents, which can influence its pharmacokinetics. As a salt, it may have enhanced stability and solubility compared to its neutral form. The stereochemistry, indicated by the (2R,3R) configuration, is crucial for its biological activity, as chirality can significantly affect the interaction with biological targets. Overall, this compound's unique structure and functional groups suggest potential applications in medicinal chemistry, particularly in the development of therapeutic agents.
Formula:C28H32BrN3O9
InChI:InChI=1/C24H26BrN3O3.C4H6O6/c1-27-13-17-8-21-24(30-3,19-5-4-6-20(27)22(17)19)9-15(12-28(21)2)14-31-23(29)16-7-18(25)11-26-10-16;5-1(3(7)8)2(6)4(9)10/h4-7,10-11,13,15,21H,8-9,12,14H2,1-3H3;1-2,5-6H,(H,7,8)(H,9,10)/t15-,21-,24-;1-,2?/m11/s1
InChI key:InChIKey=HPTSPLOLRPLNPI-APQSZEFPSA-N
SMILES:O(C)[C@@]12C=3C=4C(C[C@]1(N(C)C[C@H](COC(=O)C=5C=C(Br)C=NC5)C2)[H])=CN(C)C4C=CC3.[C@@H]([C@H](C(O)=O)O)(C(O)=O)O
Synonyms:
  • Ergoline-8-methanol, 10-methoxy-1,6-dimethyl-, 5-bromo-3-pyridinecarboxylate (ester), (8β)-, [R-(R*,R*)]-2,3-dihydroxybutanedioate (salt)
  • Ergoline-8β-methanol, 10-methoxy-1,6-dimethyl-, 5-bromonicotinate (ester), tartrate
  • Ergoline-8-methanol, 10-methoxy-1,6-dimethyl-, 5-bromo-3-pyridinecarboxylate (ester), (8β)-, (2R,3R)-2,3-dihydroxybutanedioate (salt)
  • Nicotinic acid, 5-bromo-, (10-methoxy-1,6-dimethylergolin-8β-yl)methyl ester, tartrate
  • Indolo[4,3-fg]quinoline, ergoline-8-methanol deriv.
  • Vasospan
  • 5-Bromo-3-(10-methoxy-1,6-dimethylergolin-8beta-ylmethoxycarbonyl)pyridinium hydrogen (R-(R*,R*))-tartrate
  • Nicergolyn
  • Memoq
  • Nicergoline (RR)-tartrate
  • See more synonyms
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