MSI_000011429
Unreliable
排名分数: 0.36
参考来源: Mus musculus (UBERON:0012378: muscle layer of urinary bladder)
M/z: 494.0719
Mass Window: 494.0719 ~ 494.0719 (none)
参考注释
(2r,5r)-2-[(1s,2r)-2-amino-2-carboxy-1-hydroxyethyl]-5-[(2s)-2-carboxy-2-{[(3,5-dichloro-4-hydroxyphenyl)(hydroxy)methylidene]amino}ethyl]pyrrolidine-2-carboxylic acid_[M+H]+ (BioDeep_00002219355)(2r,5r)-2-[(1s,2r)-2-amino-2-carboxy-1-hydroxyethyl]-5-[(2s)-2-carboxy-2-{[(3,5-dichloro-4-hydroxyphenyl)(hydroxy)methylidene]amino}ethyl]pyrrolidine-2-carboxylic acid
Formula: C18H21Cl2N3O9 (493.0654796)
SMILES:
N[C@@H](C(=O)O)[C@H](O)[C@@]1(C(=O)O)CC[C@H](C[C@H](N=C(O)c2cc(Cl)c(O)c(Cl)c2)C(=O)O)N1