N-[(1S,2S,8S,8aS)-8-Hydroxy-7-{(2S)-1-[(2R)-2-(methoxymethyl)-1-pyrrolidinyl]-1-oxo-2-propanyl}-1,4a-dimethyldecahydro-2-naphthalenyl]-5-pyrimidinecarboxamide

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Systematic / IUPAC Name: N-[(1S,2S,4aS,8S,8aS)-8-Hydroxy-7-[(2S)-1-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]-1-oxopropan-2-yl]-1,4a-dimethyl-2,3,4,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl]pyrimidine-5-carboxamide

ID: Reference9501

Other Names: 5-Pyrimidinecarboxamide, N-[(1S,2S,8S,8aS)-decahydro-8-hydroxy-7-[(1S)-2-[(2R)-2-(methoxymethyl)-1-pyrrolidinyl]-1-methyl-2-oxoethyl]-1,4a-dimethyl-2-naphthalenyl]-;
NAT5-397885

Formula: C26H40N4O4

Spectral Data

N-[(1S,2S,8S,8aS)-8-Hydroxy-7-{(2S)-1-[(2R)-2-(methoxymethyl)-1-pyrrolidinyl]-1-oxo-2-propanyl}-1,4a-dimethyldecahydro-2-naphthalenyl]-5-pyrimidinecarboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 2
No. of Spectra 3235
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 3/19/2020 6:32:09 AM
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Identificators

InChI InChI=1S/C26H40N4O4/c1-16(25(33)30-11-5-6-19(30)14-34-4)20-7-9-26(3)10-8-21(17(2)22(26)23(20)31)29-24(32)18-12-27-15-28-13-18/h12-13,15-17,19-23,31H,5-11,14H2,1-4H3,(H,29,32)/t16-,17+,19+,20?,21-,22+,23-,26-/m0/s1
InChI Key DBMMYSPHIVYAFT-TWQGHEAKSA-N
Canonical SMILES CC1C(CCC2(C1C(C(CC2)C(C)C(=O)N3CCCC3COC)O)C)NC(=O)C4=CN=CN=C4
CAS
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Other Names 5-Pyrimidinecarboxamide, N-[(1S,2S,8S,8aS)-decahydro-8-hydroxy-7-[(1S)-2-[(2R)-2-(methoxymethyl)-1-pyrrolidinyl]-1-methyl-2-oxoethyl]-1,4a-dimethyl-2-naphthalenyl]-;
NAT5-397885

In Other Databases

PubChem 45361636
ChemSpider 22806102