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

enlarge

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]-4-methoxybenzamide

ID: Reference12116

Other Names: NAT5-396552

Formula: C29H44N2O5

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]-4-methoxybenzamide 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 1
No. of Spectra 1705
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 1/12/2023 9:34:59 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C29H44N2O5/c1-18(28(34)31-16-6-7-21(31)17-35-4)23-12-14-29(3)15-13-24(19(2)25(29)26(23)32)30-27(33)20-8-10-22(36-5)11-9-20/h8-11,18-19,21,23-26,32H,6-7,12-17H2,1-5H3,(H,30,33)/t18-,19+,21+,23?,24-,25+,26-,29-/m0/s1
InChI Key ADQGWFQXKMYFLH-NLPCSAMBSA-N
Canonical SMILES CC1C(CCC2(C1C(C(CC2)C(C)C(=O)N3CCCC3COC)O)C)NC(=O)C4=CC=C(C=C4)OC
CAS
Splash
Other Names NAT5-396552

In Other Databases

ChemSpider 22805836
PubChem 45361383