(2S)-2-{(1S,7S,8S,8aS)-1-Hydroxy-4a,8-dimethyl-7-[(phenylacetyl)amino]decahydro-2-naphthalenyl}-N-[2-(4-morpholinyl)ethyl]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-(2-morpholin-4-ylethyl)propanamide

ID: Reference11463

Other Names: NAT5-397308

Formula: C29H45N3O4

Spectral Data

(2S)-2-{(1S,7S,8S,8aS)-1-Hydroxy-4a,8-dimethyl-7-[(phenylacetyl)amino]decahydro-2-naphthalenyl}-N-[2-(4-morpholinyl)ethyl]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 2870
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 6/15/2022 2:14:54 PM
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Identificators

InChI InChI=1S/C29H45N3O4/c1-20(28(35)30-13-14-32-15-17-36-18-16-32)23-9-11-29(3)12-10-24(21(2)26(29)27(23)34)31-25(33)19-22-7-5-4-6-8-22/h4-8,20-21,23-24,26-27,34H,9-19H2,1-3H3,(H,30,35)(H,31,33)/t20-,21+,23?,24-,26+,27-,29-/m0/s1
InChI Key HUXLCPYMVXFVOH-SDYKJARBSA-N
Canonical SMILES CC1C(CCC2(C1C(C(CC2)C(C)C(=O)NCCN3CCOCC3)O)C)NC(=O)CC4=CC=CC=C4
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Other Names NAT5-397308

In Other Databases

PubChem 45361513
ChemSpider 22805973