SpectraBase Compound ID | 6OOoogteCWN |
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InChI | InChI=1S/C33H40N2O9/c1-38-19-7-8-20-21-9-10-35-16-18-13-27(44-32(36)17-11-25(39-2)30(41-4)26(12-17)40-3)31(42-5)28(33(37)43-6)22(18)15-24(35)29(21)34-23(20)14-19/h7-8,11-12,14,18,22,24,27-28,31,34H,9-10,13,15-16H2,1-6H3/t18-,22+,24-,27?,28?,31+/m1/s1 |
InChIKey | QEVHRUUCFGRFIF-MAFIESSYSA-N |
Mol Weight | 608.7 g/mol |
Molecular Formula | C33H40N2O9 |
Exact Mass | 608.273381 g/mol |
SpectraBase Spectrum ID | BAcnqMWzN9V |
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Name | RESERPINE |
Compound Number | 44B |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C33H40N2O9 |
InChI | InChI=1S/C33H40N2O9/c1-38-19-7-8-20-21-9-10-35-16-18-13-27(44-32(36)17-11-25(39-2)30(41-4)26(12-17)40-3)31(42-5)28(33(37)43-6)22(18)15-24(35)29(21)34-23(20)14-19/h7-8,11-12,14,18,22,24,27-28,31,34H,9-10,13,15-16H2,1-6H3/t18-,22+,24-,27?,28?,31+/m1/s1 |
InChIKey | QEVHRUUCFGRFIF-MAFIESSYSA-N |
Literature Reference Author | E.WENKERT,C.J.CHANG,H.P.S.CHAWLA,D.W.COCHRAN,E.W.HAGAMAN,J.C .KING,K.ORITO |
Literature Reference Citation | J.AM.CHEM.SOC.,98,3645(1976) |
Literature Reference DOI | 10.1021/ja00428a044 |
Molecular Weight | 608.689 g/mol |
Solvent | CDCl3 |
Source File Reference | UNIW12854 |