Chem
J-GLOBAL ID:200907000117956849
Nikkaji number:J2.717.928B
(3R,4S)-6-Phenyl-3-[4-nitrophenylsulfonyl(2,4-dimethoxybenzyl)amino]-1,5-hexadiene-4-ol
(3R,4S)-6-フェニル-3-[4-ニトロフェニルスルホニル(2,4-ジメトキシベンジル)アミノ]-1,5-ヘキサジエン-4-オール
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Substance type:
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
Molecular formula:
C27 H28 N[N+]O6 [O-]S
Molecular formula furigana:
C27-H28-N2-O7-S
Molecular weight:
524.590
InChI:
InChI=1S/C27H28N2O7S/c1-4-25(26(30)17-10-20-8-6-5-7-9-20)28(19-21-11-14-23(35-2)18-27(21)36-3)37(33,34)24-15-12-22(13-16-24)29(31)32/h4-18,25-26,30H,1,19H2,2-3H3/t25-,26+/m1/s1
InChI key:
MXVZRUFYKNYFSO-FTJBHMTQSA-N
SMILES:
COc1ccc(CN([C@H](C=C)[C@@H](O)C=Cc2ccccc2)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])c(OC)c1
Systematic name (3):
(3R,4S)-6-フェニル-3-[4-ニトロフェニルスルホニル(2,4-ジメトキシベンジル)アミノ]-1,5-ヘキサジエン-4-オール
N-[(2,4-ジメトキシフェニル)メチル]-N-[(3R,4S)-4-ヒドロキシ-6-フェニルヘキサ-1,5-ジエン-3-イル]-4-ニトロベンゼン-1-スルホンアミド
N-[(2,4-dimethoxyphenyl)methyl]-N-[(3R,4S)-4-hydroxy-6-phenylhexa-1,5-dien-3-yl]-4-nitrobenzene-1-sulfonamide
Other name (1):
(3R,4S)-6-Phenyl-3-[4-nitrophenylsulfonyl(2,4-dimethoxybenzyl)amino]-1,5-hexadiene-4-ol
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