Systematic / IUPAC Name: N-[(1S,2S,4aS,8S,8aS)-7-[(2S)-1-[(3,4-Dimethoxyphenyl)methylamino]-1-oxopropan-2-yl]-8-hydroxy-1,4a-dimethyl-2,3,4,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl]-4-methoxybenzamide
ID: Reference11434
Other Names: NAT5-396566
Formula: C32H44N2O6
N-[(1S,2S,8S,8aS)-7-{(2S)-1-[(3,4-Dimethoxybenzyl)amino]-1-oxo-2-propanyl}-8-hydroxy-1,4a-dimethyldecahydro-2-naphthalenyl]-4-methoxybenzamide 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 | 2531 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 5/31/2022 12:42:07 PM |
InChI | InChI=1S/C32H44N2O6/c1-19(30(36)33-18-21-7-12-26(39-5)27(17-21)40-6)24-13-15-32(3)16-14-25(20(2)28(32)29(24)35)34-31(37)22-8-10-23(38-4)11-9-22/h7-12,17,19-20,24-25,28-29,35H,13-16,18H2,1-6H3,(H,33,36)(H,34,37)/t19-,20+,24?,25-,28+,29-,32-/m0/s1 |
InChI Key | USNVHGQBLZRSHK-GQZVKALUSA-N |
Canonical SMILES | CC1C(CCC2(C1C(C(CC2)C(C)C(=O)NCC3=CC(=C(C=C3)OC)OC)O)C)NC(=O)C4=CC=C(C=C4)OC |
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Other Names | NAT5-396566 |