Systematic / IUPAC Name: (2S)-2-[(1S,2S,4aS,7S,8S,8aS)-7-(Ethylcarbamoylamino)-1-hydroxy-4a,8-dimethyl-2,3,4,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl]-N-(furan-2-ylmethyl)propanamide
ID: Reference11260
Other Names: NAT5-397922
Formula: C23H37N3O4
(2S)-2-{(1S,2S,4aS,7S,8S,8aS)-7-[(Ethylcarbamoyl)amino]-1-hydroxy-4a,8-dimethyldecahydro-2-naphthalenyl}-N-(2-furylmethyl)propanamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 1000 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 3/4/2022 10:48:49 AM |
InChI | InChI=1S/C23H37N3O4/c1-5-24-22(29)26-18-9-11-23(4)10-8-17(20(27)19(23)15(18)3)14(2)21(28)25-13-16-7-6-12-30-16/h6-7,12,14-15,17-20,27H,5,8-11,13H2,1-4H3,(H,25,28)(H2,24,26,29)/t14-,15+,17-,18-,19+,20-,23-/m0/s1 |
InChI Key | HAEVNKBSBWLOMO-ORZDUAMFSA-N |
Canonical SMILES | CCNC(=O)NC1CCC2(CCC(C(C2C1C)O)C(C)C(=O)NCC3=CC=CO3)C |
CAS | |
Splash | |
Other Names | NAT5-397922 |