N-{(1S,2S,8S,8aS)-8-Hydroxy-1,4a-dimethyl-7-[(2S)-1-oxo-1-(1-piperidinyl)-2-propanyl]decahydro-2-naphthalenyl}-4-methoxybenzamide

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

ID: Reference12120

Other Names: NAT5-396562

Formula: C28H42N2O4

Spectral Data

N-{(1S,2S,8S,8aS)-8-Hydroxy-1,4a-dimethyl-7-[(2S)-1-oxo-1-(1-piperidinyl)-2-propanyl]decahydro-2-naphthalenyl}-4-methoxybenzamide 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 1539
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 1/12/2023 9:50:36 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C28H42N2O4/c1-18(27(33)30-16-6-5-7-17-30)22-12-14-28(3)15-13-23(19(2)24(28)25(22)31)29-26(32)20-8-10-21(34-4)11-9-20/h8-11,18-19,22-25,31H,5-7,12-17H2,1-4H3,(H,29,32)/t18-,19+,22?,23-,24+,25-,28-/m0/s1
InChI Key GUGPRZVEWMEZDK-LIXWPVDFSA-N
Canonical SMILES CC1C(CCC2(C1C(C(CC2)C(C)C(=O)N3CCCCC3)O)C)NC(=O)C4=CC=C(C=C4)OC
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Other Names NAT5-396562

In Other Databases

PubChem 45361389
ChemSpider 22805842