Chem
J-GLOBAL ID:200907057622052824
Nikkaji number:J10.471J
MP 2032
ヨーカルム酸
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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:
C24 H20 I6 N4 O8
Molecular formula furigana:
C24-H20-I6-N4-O8
Molecular weight:
1253.871
InChI:
InChI=1S/C24H20I6N4O8/c1-31-21(37)9-13(25)11(23(39)40)17(29)19(15(9)27)33-7(35)5-3-4-6-8(36)34-20-16(28)10(22(38)32-2)14(26)12(18(20)30)24(41)42/h3-6H2,1-2H3,(H,31,37)(H,32,38)(H,33,35)(H,34,36)(H,39,40)(H,41,42)
InChI key:
SMQYOVYWPWASGU-UHFFFAOYSA-N
SMILES:
CNC(=O)c1c(I)c(NC(=O)CCCCC(=O)Nc2c(I)c(C(=O)O)c(I)c(C(=O)NC)c2I)c(I)c(C(=O)O)c1I
Systematic name (6):
3,3′-[(1,6-ジオキソ-1,6-ヘキサンジイル)ビスイミノ]ビス[2,4,6-トリヨード-5-[(メチルアミノ)カルボニル]安息香酸]
5,5′-[テトラメチレンビス(カルボニルイミノ)]ビス[3-(メチルカルバモイル)-2,4,6-トリヨード安息香酸]
3,3′-[(1,6-ジオキソヘキサン-1,6-ジイル)ジイミノ]ビス[2,4,6-トリヨード-5-[(メチルアミノ)カルボニル]安息香酸]
3,3′-[テトラメチレンビス(カルボニルイミノ)]ビス(2,4,6-トリヨード-5-メチルカルバモイル安息香酸)
3-(5-{[3-カルボキシ-2,4,6-トリヨード-5-(メチルカルバモイル)フェニル]カルバモイル}ペンタンアミド)-2,4,6-トリヨード-5-(メチルカルバモイル)安息香酸
3-(5-{[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)phenyl]carbamoyl}pentanamido)-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid
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Other name (6):
ヨーカルム酸
MP 2032
Iocarmic acid
3,3′-[Tetramethylenebis(carbonylimino)]bis(2,4,6-triiodo-5-methylcarbamoylbenzoic acid)
5,5′-[Tetramethylenebis(carbonylimino)]bis[3-(methylcarbamoyl)-2,4,6-triiodobenzoic acid]
3,3′-[(1,6-Dioxohexane-1,6-diyl)diimino]bis[2,4,6-triiodo-5-[(methylamino)carbonyl]benzoic acid]
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CAS registry number:
10397-75-8
Regulation number (3):
4-(4)-384
NT1999400
EINECS2338618
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