Chem
J-GLOBAL ID：200907094601443540
Nikkaji number：J2.037.602C
(2R,3R)-5-[(S)-3-(tert-Butylamino)-2-hydroxypropoxy]-1,2,3,4-tetrahydro-2,3-naphthalenediol
(2R,3R)-5-[(S)-3-(tert-ブチルアミノ)-2-ヒドロキシプロポキシ]-1,2,3,4-テトラヒドロ-2,3-ナフタレンジオール
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C17H27NO4
Molecular formula furigana： C17-H27-N-O4
Molecular weight： 309.406
InChI：
InChI=1S/C17H27NO4/c1-17(2,3)18-9-12(19)10-22-16-6-4-5-11-7-14(20)15(21)8-13(11)16/h4-6,12,14-15,18-21H,7-10H2,1-3H3/t12-,14+,15+/m0/s1
InChI key：
VWPOSFSPZNDTMJ-NWANDNLSSA-N
SMILES：
CC(C)(C)NC[C@H](O)COc1cccc2C[C@@H](O)[C@H](O)Cc12
Systematic name (3)：
- (2R,3R)-5-[(S)-3-(tert-ブチルアミノ)-2-ヒドロキシプロポキシ]-1,2,3,4-テトラヒドロ-2,3-ナフタレンジオール
- (2R,3R)-5-[(2S)-3-(tert-ブチルアミノ)-2-ヒドロキシプロポキシ]-1,2,3,4-テトラヒドロナフタレン-2,3-ジオール
- (2R,3R)-5-[(2S)-3-(tert-butylamino)-2-hydroxypropoxy]-1,2,3,4-tetrahydronaphthalene-2,3-diol
- (2R,3R)-5-[(S)-3-(tert-Butylamino)-2-hydroxypropoxy]-1,2,3,4-tetrahydro-2,3-naphthalenediol
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