N-[7-Hydroxy-8-(hydroxymethyl)-4-{2-[(3-hydroxyphenyl)amino]-2-oxoethyl}-4a,8-dimethyl-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-2-yl]-3,3-dimethylbutanamide

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Systematic / IUPAC Name: N-[7-Hydroxy-4-[2-(3-hydroxyanilino)-2-oxoethyl]-8-(hydroxymethyl)-4a,8-dimethyl-4,5,6,7,8a,9-hexahydrobenzo[f][1,3]benzothiazol-2-yl]-3,3-dimethylbutanamide

ID: Reference9300

Other Names: Naphtho[2,3-d]thiazole-4-acetamide, 2-[(3,3-dimethyl-1-oxobutyl)amino]-4,4a,5,6,7,8,8a,9-octahydro-7-hydroxy-8-(hydroxymethyl)-N-(3-hydroxyphenyl)-4a,8-dimethyl-;
NAT8-283426

Formula: C28H39N3O5S

Spectral Data

N-[7-Hydroxy-8-(hydroxymethyl)-4-{2-[(3-hydroxyphenyl)amino]-2-oxoethyl}-4a,8-dimethyl-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-2-yl]-3,3-dimethylbutanamide 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 FAIMS
No. of Spectral Trees 1
No. of Spectra 3357
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6, MS7
Ionization Methods NSI
Analyzers FT
Last Modification 1/24/2020 9:41:20 AM
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Identificators

InChI InChI=1S/C28H39N3O5S/c1-26(2,3)14-23(36)30-25-31-24-18(12-22(35)29-16-7-6-8-17(33)11-16)27(4)10-9-21(34)28(5,15-32)20(27)13-19(24)37-25/h6-8,11,18,20-21,32-34H,9-10,12-15H2,1-5H3,(H,29,35)(H,30,31,36)
InChI Key BZNXCKDYJSMOAA-UHFFFAOYSA-N
Canonical SMILES CC12CCC(C(C1CC3=C(C2CC(=O)NC4=CC(=CC=C4)O)N=C(S3)NC(=O)CC(C)(C)C)(C)CO)O
CAS
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Other Names Naphtho[2,3-d]thiazole-4-acetamide, 2-[(3,3-dimethyl-1-oxobutyl)amino]-4,4a,5,6,7,8,8a,9-octahydro-7-hydroxy-8-(hydroxymethyl)-N-(3-hydroxyphenyl)-4a,8-dimethyl-;
NAT8-283426

In Other Databases

ChemSpider 3833993
PubChem 4644240