(2S)-N-Cyclohexyl-2-{(1S,7S,8S,8aS)-1-hydroxy-4a,8-dimethyl-7-[(phenylacetyl)amino]decahydro-2-naphthalenyl}propanamide

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Systematic / IUPAC Name: (2S)-2-[(1S,4aS,7S,8S,8aS)-1-Hydroxy-4a,8-dimethyl-7-[(2-phenylacetyl)amino]-2,3,4,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl]-N-cyclohexylpropanamide

ID: Reference11470

Other Names: NAT5-397315

Formula: C29H44N2O3

Spectral Data

(2S)-N-Cyclohexyl-2-{(1S,7S,8S,8aS)-1-hydroxy-4a,8-dimethyl-7-[(phenylacetyl)amino]decahydro-2-naphthalenyl}propanamide 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 3016
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 6/23/2022 11:15:55 AM
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Identificators

InChI InChI=1S/C29H44N2O3/c1-19(28(34)30-22-12-8-5-9-13-22)23-14-16-29(3)17-15-24(20(2)26(29)27(23)33)31-25(32)18-21-10-6-4-7-11-21/h4,6-7,10-11,19-20,22-24,26-27,33H,5,8-9,12-18H2,1-3H3,(H,30,34)(H,31,32)/t19-,20+,23?,24-,26+,27-,29-/m0/s1
InChI Key UTDLFLXAYSODMF-WBFVDTNBSA-N
Canonical SMILES CC1C(CCC2(C1C(C(CC2)C(C)C(=O)NC3CCCCC3)O)C)NC(=O)CC4=CC=CC=C4
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Other Names NAT5-397315

In Other Databases

PubChem 45361515
ChemSpider 22805975