Chem
J-GLOBAL ID：200907034376476512   Nikkaji number：J1.853.345F

L-Ala-O-[3-O-(β-D-Galactopyranosyl)-α-D-galactopyranosyl]-L-Thr-L-Ala-OH

L-Ala-O-[3-O-(β-D-ガラクトピラノシル)-α-D-ガラクトピラノシル]-L-Thr-L-Ala-OH
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： C22H39N3O15
Molecular formula furigana： C22-H39-N3-O15
Molecular weight： 585.560
InChI： InChI=1S/C22H39N3O15/c1-6(23)18(33)25-11(19(34)24-7(2)20(35)36)8(3)37-22-16(32)17(13(29)10(5-27)39-22)40-21-15(31)14(30)12(28)9(4-26)38-21/h6-17,21-22,26-32H,4-5,23H2,1-3H3,(H,24,34)(H,25,33)(H,35,36)/t6-,7-,8+,9+,10+,11-,12-,13-,14-,15+,16+,17-,21-,22-/m0/s1
InChI key： QRRPRWRKMXJNBB-XEZSQOOISA-N
SMILES： C[C@H](N)C(=O)N[C@@H]([C@@H](C)O[C@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H]1O)C(=O)N[C@@H](C)C(=O)O
Systematic name  (3)：
  • L-Ala-O-[3-O-(β-D-ガラクトピラノシル)-α-D-ガラクトピラノシル]-L-Thr-L-Ala-OH
  • (2S)-2-[(2S,3R)-2-[(2S)-2-アミノプロパンアミド]-3-{[(2S,3R,4S,5S,6R)-3,5-ジヒドロキシ-6-(ヒドロキシメチル)-4-{[(2S,3R,4S,5R,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}オキサン-2-イル]オキシ}ブタンアミド]プロパン酸
  • (2S)-2-[(2S,3R)-2-[(2S)-2-aminopropanamido]-3-{[(2S,3R,4S,5S,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}butanamido]propanoic acid
Other name (1)：
  • L-Ala-O-[3-O-(β-D-Galactopyranosyl)-α-D-galactopyranosyl]-L-Thr-L-Ala-OH
Thsaurus map：
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