N-[(4S,4aR,7R,8R,8aS)-4-[2-(Cyclohexylamino)-2-oxoethyl]-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-2-yl]cyclobutanecarboxamide

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Systematic / IUPAC Name: N-[(4S,4aR,7R,8R,8aS)-4-[2-(Cyclohexylamino)-2-oxoethyl]-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4,5,6,7,8a,9-hexahydrobenzo[f][1,3]benzothiazol-2-yl]cyclobutanecarboxamide

ID: Reference11971

Other Names: NAT8-264212

Formula: C27H41N3O4S

Spectral Data

N-[(4S,4aR,7R,8R,8aS)-4-[2-(Cyclohexylamino)-2-oxoethyl]-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-2-yl]cyclobutanecarboxamide 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 1274
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 11/21/2022 2:44:36 PM
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Identificators

InChI InChI=1S/C27H41N3O4S/c1-26-12-11-21(32)27(2,15-31)20(26)14-19-23(29-25(35-19)30-24(34)16-7-6-8-16)18(26)13-22(33)28-17-9-4-3-5-10-17/h16-18,20-21,31-32H,3-15H2,1-2H3,(H,28,33)(H,29,30,34)/t18-,20+,21-,26+,27+/m1/s1
InChI Key OHXRVSZQDCJCJR-BWSFKYGTSA-N
Canonical SMILES CC12CCC(C(C1CC3=C(C2CC(=O)NC4CCCCC4)N=C(S3)NC(=O)C5CCC5)(C)CO)O
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Other Names NAT8-264212

In Other Databases

ChemSpider 10057425
PubChem 11883097