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

ID: Reference12163

Other Names: NAT5-397312

Formula: C29H46N2O5

Spectral Data

(2S)-2-{(1S,7S,8S,8aS)-1-Hydroxy-4a,8-dimethyl-7-[(phenylacetyl)amino]decahydro-2-naphthalenyl}-N,N-bis(2-methoxyethyl)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 1776
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 1/24/2023 9:38:43 AM
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Identificators

InChI InChI=1S/C29H46N2O5/c1-20(28(34)31(15-17-35-4)16-18-36-5)23-11-13-29(3)14-12-24(21(2)26(29)27(23)33)30-25(32)19-22-9-7-6-8-10-22/h6-10,20-21,23-24,26-27,33H,11-19H2,1-5H3,(H,30,32)/t20-,21+,23?,24-,26+,27-,29-/m0/s1
InChI Key RIMPQGVEKYGCST-SDYKJARBSA-N
Canonical SMILES CC1C(CCC2(C1C(C(CC2)C(C)C(=O)N(CCOC)CCOC)O)C)NC(=O)CC3=CC=CC=C3
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Other Names NAT5-397312

In Other Databases

ChemSpider 22937594
PubChem 45784365