Chem
J-GLOBAL ID:200907038222066457
Nikkaji number:J1.579.267A
1-C,6-O-[Carbonylimino[(2R)-3-hydroxy-1-oxopropane-2,1-diyl]imino[(3S)-1-oxo-3-[(1,3-dicarboxypropyl)carbamoyl]-3,1-propanediyl]]-1-deoxy-α-L-galactopyranose
1-C,6-O-[カルボニルイミノ[(2R)-3-ヒドロキシ-1-オキソプロパン-2,1-ジイル]イミノ[(3S)-1-オキソ-3-[(1,3-ジカルボキシプロピル)カルバモイル]-3,1-プロパンジイル]]-1-デオキシ-α-L-ガラクトピラノース
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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:
C19 H27 N3 O14
Molecular formula furigana:
C19-H27-N3-O14
Molecular weight:
521.432
InChI:
InChI=1S/C19H27N3O14/c23-4-8-17(31)21-7(16(30)20-6(19(33)34)1-2-10(24)25)3-11(26)35-5-9-12(27)13(28)14(29)15(36-9)18(32)22-8/h6-9,12-15,23,27-29H,1-5H2,(H,20,30)(H,21,31)(H,22,32)(H,24,25)(H,33,34)/t6?,7-,8+,9-,12+,13+,14-,15+/m0/s1
InChI key:
VBBYYXFPJXDCSF-FFNKBAFUSA-N
SMILES:
OC[C@H]1NC(=O)[C@@H]2O[C@@H](COC(=O)C[C@H](NC1=O)C(=O)NC(CCC(=O)O)C(=O)O)[C@@H](O)[C@@H](O)[C@@H]2O
Systematic name (3):
1-C,6-O-[カルボニルイミノ[(2R)-3-ヒドロキシ-1-オキソプロパン-2,1-ジイル]イミノ[(3S)-1-オキソ-3-[(1,3-ジカルボキシプロピル)カルバモイル]-3,1-プロパンジイル]]-1-デオキシ-α-L-ガラクトピラノース
2-{[(1R,4R,7S,12S,13S,14R,15S)-13,14,15-トリヒドロキシ-4-(ヒドロキシメチル)-2,5,9-トリオキソ-10,16-ジオキサ-3,6-ジアザビシクロ[10.3.1]ヘキサデカン-7-イル]ホルムアミド}ペンタン二酸
2-{[(1R,4R,7S,12S,13S,14R,15S)-13,14,15-trihydroxy-4-(hydroxymethyl)-2,5,9-trioxo-10,16-dioxa-3,6-diazabicyclo[10.3.1]hexadecan-7-yl]formamido}pentanedioic acid
Other name (1):
1-C,6-O-[Carbonylimino[(2R)-3-hydroxy-1-oxopropane-2,1-diyl]imino[(3S)-1-oxo-3-[(1,3-dicarboxypropyl)carbamoyl]-3,1-propanediyl]]-1-deoxy-α-L-galactopyranose
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