Chem
J-GLOBAL ID:200907062655211476
Nikkaji number:J542.180B
Desulphoglucobrassicin
デスルホグルコブラッシシン
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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:
C16 H20 N2 O6 S
Molecular formula furigana:
C16-H20-N2-O6-S
Molecular weight:
368.400
InChI:
InChI=1S/C16H20N2O6S/c19-7-11-13(20)14(21)15(22)16(24-11)25-12(18-23)5-8-6-17-10-4-2-1-3-9(8)10/h1-4,6,11,13-17,19-23H,5,7H2/t11-,13-,14+,15-,16+/m1/s1
InChI key:
CWNIQCOMWQROPA-JZYAIQKZSA-N
SMILES:
OC[C@H]1O[C@@H](SC(=NO)Cc2c[nH]c3ccccc23)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name (6):
1-チオ-β-D-グルコピラノース1-[N-ヒドロキシ-1H-インドール-3-(エタンイミダート)]
2-(1H-インドール-3-イル)-1-(ヒドロキシイミノ)エチル1-チオ-β-D-グルコピラノシド
S-β-D-グルコピラノシル-1H-インドール-3-イルアセトヒドロキシムチオ酸
3-[2-(ヒドロキシイミノ)-2-(β-D-グルコピラノシルチオ)エチル]-1H-インドール
(2S,3R,4S,5S,6R)-2-{[1-(ヒドロキシイミノ)-2-(1H-インドール-3-イル)エチル]スルファニル}-6-(ヒドロキシメチル)オキサン-3,4,5-トリオール
(2S,3R,4S,5S,6R)-2-{[1-(hydroxyimino)-2-(1H-indol-3-yl)ethyl]sulfanyl}-6-(hydroxymethyl)oxane-3,4,5-triol
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Other name (8):
デスルホグルコブラッシシン
Desulphoglucobrassicin
1-Thio-β-D-glucopyranose 1-[N-hydroxy-1H-indole-3-(ethaneimidate)]
2-(1H-Indole-3-yl)-1-(hydroxyimino)ethyl 1-thio-β-D-glucopyranoside
S-β-D-Glucopyranosyl-1H-indole-3-ylacetohydroximethioic acid
Indolylmethyl-desulfoglucosinolate
インドリルメチル-デスルホグルシノール酸
3-[2-(Hydroxyimino)-2-(β-D-glucopyranosylthio)ethyl]-1H-indole
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CAS registry number:
43110-92-5
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