(2S)-N-Allyl-2-{(4S,4aS,5S)-2-[(N,N-dimethylglycyl)amino]-5-hydroxy-4,8a-dimethyl-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-6-yl}-N-methylpropanamide
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Reference
(2S)-N-Allyl-2-{(4S,4aS,5S)-2-[(N,N-dimethylglycyl)amino]-5-hydroxy-4,8a-dimethyl-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-6-yl}-N-methylpropanamide Structure
Systematic / IUPAC Name: (2S)-2-[(4S,4aS,5S,8aS)-2-[[2-(Dimethylamino)acetyl]amino]-5-hydroxy-4,8a-dimethyl-4a,5,6,7,8,9-hexahydro-4H-benzo[f][1,3]benzothiazol-6-yl]-N-methyl-N-prop-2-enylpropanamide
ID: Reference12345
Other Names: NAT5-257564
Formula: C24H38N4O3S
Spectral Data
(2S)-N-Allyl-2-{(4S,4aS,5S)-2-[(N,N-dimethylglycyl)amino]-5-hydroxy-4,8a-dimethyl-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-6-yl}-N-methylpropanamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 1 |
| No. of Spectra | 1292 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 3/7/2023 11:43:51 AM |
Identificators
| InChI | InChI=1S/C24H38N4O3S/c1-8-11-28(7)22(31)14(2)16-9-10-24(4)12-17-20(15(3)19(24)21(16)30)26-23(32-17)25-18(29)13-27(5)6/h8,14-16,19,21,30H,1,9-13H2,2-7H3,(H,25,26,29)/t14-,15-,16?,19+,21-,24-/m0/s1 |
| InChI Key | HUHZRKCFOAXIKG-MCZBTUONSA-N |
| Canonical SMILES | CC1C2C(C(CCC2(CC3=C1N=C(S3)NC(=O)CN(C)C)C)C(C)C(=O)N(C)CC=C)O |
| CAS | |
| Splash | |
| Other Names | NAT5-257564 |