SpectraBase Compound ID | D0QuVrvWBKM |
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InChI | InChI=1S/C38H42N4O6/c1-3-15-41-17-13-35-29-21-5-7-25(43)31(29)47-33(35)23(9-11-37(35,45)27(41)19-21)39-40-24-10-12-38(46)28-20-22-6-8-26(44)32-30(22)36(38,34(24)48-32)14-18-42(28)16-4-2/h3-8,27-28,33-34,43-46H,1-2,9-20H2/b39-23+,40-24+/t27-,28-,33?,34?,35+,36+,37-,38?/m0/s1 |
InChIKey | AJPSBXJNFJCCBI-NZASLNAFSA-N |
Mol Weight | 650.8 g/mol |
Molecular Formula | C38H42N4O6 |
Exact Mass | 650.310435 g/mol |
SpectraBase Spectrum ID | 98L8gBo9Eoa |
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Name | NALOXONE-AZINE |
CAS Registry Number | 91796-64-4 |
Compound Number | 7 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C38H42N4O6 |
InChI | InChI=1S/C38H42N4O6/c1-3-15-41-17-13-35-29-21-5-7-25(43)31(29)47-33(35)23(9-11-37(35,45)27(41)19-21)39-40-24-10-12-38(46)28-20-22-6-8-26(44)32-30(22)36(38,34(24)48-32)14-18-42(28)16-4-2/h3-8,27-28,33-34,43-46H,1-2,9-20H2/b39-23+,40-24+/t27-,28-,33?,34?,35+,36+,37-,38?/m0/s1 |
InChIKey | AJPSBXJNFJCCBI-NZASLNAFSA-N |
Literature Reference Author | V.M.KOLB,D.H.HUA |
Literature Reference Citation | J.ORG.CHEM.,49,3824(1984) |
Literature Reference DOI | 10.1021/jo00194a029 |
Molecular Weight | 650.775 g/mol |
Solvent | CDCl3 |
Source File Reference | UWCS12481 |