| SpectraBase Compound ID | 1LknJeZTuzj |
|---|---|
| InChI | InChI=1S/C33H38N4O4/c1-22(2)29(37(3)4)33(40)36-28-30(25-13-9-6-10-14-25)41-26-17-15-23(16-18-26)19-20-34-31(38)27(35-32(28)39)21-24-11-7-5-8-12-24/h5-20,22,27-30H,21H2,1-4H3,(H,34,38)(H,35,39)(H,36,40)/b20-19-/t27-,28-,29-,30+/m0/s1 |
| InChIKey | QMQZKCJJHAIMPG-RIINEJRYSA-N |
| Mol Weight | 554.7 g/mol |
| Molecular Formula | C33H38N4O4 |
| Exact Mass | 554.289306 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DB78HNR73W4 |
|---|---|
| Name | Integerressin |
| Alternate Name(s) | (2S)-2-(dimethylamino)-N-[(2Z,6S,9S,10R)-5,8-dioxo-10-phenyl-6-(phenylmethyl)-11-oxa-4,7-diazabicyclo[10.2.2]hexadeca-1(14),2,12,15-tetraen-9-yl]-3-methylbutanamide (2S)-N-[(2Z,6S,9S,10R)-6-benzyl-5,8-dioxo-10-phenyl-11-oxa-4,7-diazabicyclo[10.2.2]hexadeca-1(14),2,12,15-tetraen-9-yl]-2-(dimethylamino)-3-methylbutanamide (2S)-N-[(2Z,6S,9S,10R)-6-benzyl-5,8-dioxo-10-phenyl-11-oxa-4,7-diazabicyclo[10.2.2]hexadeca-1(14),2,12,15-tetraen-9-yl]-2-(dimethylamino)-3-methyl-butanamide (2S)-N-[(2Z,6S,9S,10R)-5,8-bis(oxidanylidene)-10-phenyl-6-(phenylmethyl)-11-oxa-4,7-diazabicyclo[10.2.2]hexadeca-1(14),2,12,15-tetraen-9-yl]-2-(dimethylamino)-3-methyl-butanamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C33H38N4O4 |
| InChI | InChI=1S/C33H38N4O4/c1-22(2)29(37(3)4)33(40)36-28-30(25-13-9-6-10-14-25)41-26-17-15-23(16-18-26)19-20-34-31(38)27(35-32(28)39)21-24-11-7-5-8-12-24/h5-20,22,27-30H,21H2,1-4H3,(H,34,38)(H,35,39)(H,36,40)/b20-19-/t27-,28-,29-,30+/m0/s1 |
| InChIKey | QMQZKCJJHAIMPG-RIINEJRYSA-N |
| Molecular Weight | 554.691 g/mol |
| SMILES | N1[C@](C(N\C=C/c2ccc(O[C@@]([C@@](C1=O)(NC([C@@](N(C)C)(C(C)C)[H])=O)[H])(c1ccccc1)[H])cc2)=O)(Cc1ccccc1)[H] |
| SPLASH | splash10-0udi-0900000000-cedc58ca4344634ad7d5 |
| Source of Spectrum | JX-2015-6-6745 |
| Wiley ID | 1729467 |