![[3-(4'-NITRO)-CINNAMAMIDO-OLEAN-12-EN-28-YL]-[4-(4'-NITRO)-CINNAMAMIDO-PIPERAZIN-1-YL]-METHANONE](/api/spectrum/9JlvgIUyhMK/structure.png?h=300&w=458 "[3-(4'-NITRO)-CINNAMAMIDO-OLEAN-12-EN-28-YL]-[4-(4'-NITRO)-CINNAMAMIDO-PIPERAZIN-1-YL]-METHANONE")
| SpectraBase Compound ID | IKhxe12aVdY |
|---|---|
| InChI | InChI=1S/C52H67N5O7/c1-47(2)26-28-52(46(60)55-32-30-54(31-33-55)45(59)21-13-36-10-16-38(17-11-36)57(63)64)29-27-50(6)39(40(52)34-47)18-19-42-49(5)24-23-43(48(3,4)41(49)22-25-51(42,50)7)53-44(58)20-12-35-8-14-37(15-9-35)56(61)62/h8-18,20-21,40-43H,19,22-34H2,1-7H3,(H,53,58)/b20-12+,21-13+/t40-,41-,42+,43-,49-,50+,51+,52-/m0/s1 |
| InChIKey | ZSBSJAGLDDAYCJ-QTEPENTRSA-N |
| Mol Weight | 874.1 g/mol |
| Molecular Formula | C52H67N5O7 |
| Exact Mass | 873.50405 g/mol |
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| SpectraBase Spectrum ID | 9JlvgIUyhMK |
|---|---|
| Name | [3-(4'-NITRO)-CINNAMAMIDO-OLEAN-12-EN-28-YL]-[4-(4'-NITRO)-CINNAMAMIDO-PIPERAZIN-1-YL]-METHANONE |
| Compound Number | 22 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H67N5O7 |
| InChI | InChI=1S/C52H67N5O7/c1-47(2)26-28-52(46(60)55-32-30-54(31-33-55)45(59)21-13-36-10-16-38(17-11-36)57(63)64)29-27-50(6)39(40(52)34-47)18-19-42-49(5)24-23-43(48(3,4)41(49)22-25-51(42,50)7)53-44(58)20-12-35-8-14-37(15-9-35)56(61)62/h8-18,20-21,40-43H,19,22-34H2,1-7H3,(H,53,58)/b20-12+,21-13+/t40-,41-,42+,43-,49-,50+,51+,52-/m0/s1 |
| InChIKey | ZSBSJAGLDDAYCJ-QTEPENTRSA-N |
| Literature Reference Author | W.NIE,J.G.LUO,X.B.WANG,H.YIN,H.B.SUN,H.Q.YAO,L.Y.KONG |
| Literature Reference Citation | CHEM.PHARM.BULL.,59,1051(2011) |
| Literature Reference DOI | 10.1248/cpb.59.1051 |
| Molecular Weight | 874.133 g/mol |
| Source File Reference | UWIR3514 |