| SpectraBase Compound ID | KV7TBCwloIj |
|---|---|
| InChI | InChI=1S/C28H46N2O2/c1-17(2)16-25(31)29-24-13-15-28(5)22-12-14-27(4)20(18(3)30(6)7)10-11-21(27)19(22)8-9-23(28)26(24)32/h10,16,18-19,21-24,26,32H,8-9,11-15H2,1-7H3,(H,29,31)/t18-,19-,21-,22-,23-,24-,26+,27+,28+/m0/s1 |
| InChIKey | UBWMSSICUOCSHT-BJHCZKLTSA-N |
| Mol Weight | 442.7 g/mol |
| Molecular Formula | C28H46N2O2 |
| Exact Mass | 442.355929 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ElFmAxTDo1Y |
|---|---|
| Name | Hookerianamide J |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H46N2O2 |
| InChI | InChI=1S/C28H46N2O2/c1-17(2)16-25(31)29-24-13-15-28(5)22-12-14-27(4)20(18(3)30(6)7)10-11-21(27)19(22)8-9-23(28)26(24)32/h10,16,18-19,21-24,26,32H,8-9,11-15H2,1-7H3,(H,29,31)/t18-,19-,21-,22-,23-,24-,26+,27+,28+/m0/s1 |
| InChIKey | UBWMSSICUOCSHT-BJHCZKLTSA-N |
| Molecular Weight | 442.688 g/mol |
| SMILES | N(C(C=C(C)C)=O)[C@]1(CC[C@]2([C@]([C@]1(O)[H])(CC[C@@]1([C@@]2(CC[C@]2([C@]1(CC=C2[C@@](N(C)C)(C)[H])[H])C)[H])[H])[H])C)[H] |
| SPLASH | splash10-056r-3000900000-bb4013cb830b552229cc |
| Source of Spectrum | G4-71-1483-1 |
| Synonyms | N-[(3S,4R,5R,8R,9S,10R,13S,14S)-17-[(1S)-1-(dimethylamino)ethyl]-4-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]-3-methyl-2-butenamide N-[(3S,4R,5R,8R,9S,10R,13S,14S)-17-[(1S)-1-(dimethylamino)ethyl]-4-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]-3-methylbut-2-enamide N-[(3S,4R,5R,8R,9S,10R,13S,14S)-17-[(1S)-1-(dimethylamino)ethyl]-10,13-dimethyl-4-oxidanyl-2,3,4,5,6,7,8,9,11,12,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]-3-methyl-but-2-enamide |
| Wiley ID | 1695073 |