| SpectraBase Spectrum ID |
B57e4proXfU |
| Name |
1,5,9,13-Tetraazacycloheptadecan-6-one, 9,13-diacetyl-5-benzoyl-1-(1-oxo-3-phenyl-2-propenyl)-8-phenyl-, [S-(E)]- |
| Alternate Name(s) |
(8S)-9,13-diacetyl-5-benzoyl-8-phenyl-1-[(2E)-3-phenyl-2-propenoyl]-1,5,9,13-tetraazacycloheptadecan-6-one
9-Acetyl-5-benzoylverbascenin
9-Acetyl-5-benzoylverbascenine |
| CAS Registry Number |
85570-70-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C39H46N4O5 |
| InChI |
InChI=1S/C39H46N4O5/c1-31(44)40-24-12-13-25-41(37(46)23-22-33-16-6-3-7-17-33)27-15-29-43(39(48)35-20-10-5-11-21-35)38(47)30-36(34-18-8-4-9-19-34)42(32(2)45)28-14-26-40/h3-11,16-23,36H,12-15,24-30H2,1-2H3/b23-22+/t36-/m0/s1 |
| InChIKey |
SGRMBFUFHAHWTG-XJFXDDNPSA-N |
| Molecular Weight |
650.820 g/mol |
| SMILES |
C1(N(CCCN(CCCCN(CCCN([C@@](C1)(c1ccccc1)[H])C(=O)C)C(=O)C)C(\C=C\c1ccccc1)=O)C(=O)c1ccccc1)=O |
| SPLASH |
splash10-0zir-5900000000-ddad28d1daf8e937cb2b |
| Source of Spectrum |
H-65-2546-0 |
| Wiley ID |
1413133 |
![1,5,9,13-Tetraazacycloheptadecan-6-one, 9,13-diacetyl-5-benzoyl-1-(1-oxo-3-phenyl-2-propenyl)-8-phenyl-, [S-(E)]-](/api/spectrum/B57e4proXfU/structure.png?h=300&w=458 "1,5,9,13-Tetraazacycloheptadecan-6-one, 9,13-diacetyl-5-benzoyl-1-(1-oxo-3-phenyl-2-propenyl)-8-phenyl-, [S-(E)]-")
