N-{(1S,2S,8S,8aS)-7-[(2S)-1-(Cyclohexylamino)-1-oxo-2-propanyl]-8-hydroxy-1,4a-dimethyldecahydro-2-naphthalenyl}-3,3-dimethylbutanamide

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Systematic / IUPAC Name: N-[(1S,2S,4aS,8S,8aS)-7-[(2S)-1-(Cyclohexylamino)-1-oxopropan-2-yl]-8-hydroxy-1,4a-dimethyl-2,3,4,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl]-3,3-dimethylbutanamide

ID: Reference11495

Other Names: NAT5-396670

Formula: C27H48N2O3

Spectral Data

N-{(1S,2S,8S,8aS)-7-[(2S)-1-(Cyclohexylamino)-1-oxo-2-propanyl]-8-hydroxy-1,4a-dimethyldecahydro-2-naphthalenyl}-3,3-dimethylbutanamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 2946
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 6/23/2022 8:51:18 AM
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Identificators

InChI InChI=1S/C27H48N2O3/c1-17(25(32)28-19-10-8-7-9-11-19)20-12-14-27(6)15-13-21(18(2)23(27)24(20)31)29-22(30)16-26(3,4)5/h17-21,23-24,31H,7-16H2,1-6H3,(H,28,32)(H,29,30)/t17-,18+,20?,21-,23+,24-,27-/m0/s1
InChI Key UOOTXJCACVIGDF-VFVRIHJJSA-N
Canonical SMILES CC1C(CCC2(C1C(C(CC2)C(C)C(=O)NC3CCCCC3)O)C)NC(=O)CC(C)(C)C
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Other Names NAT5-396670

In Other Databases

ChemSpider 22805869
PubChem 45361414