PDB CCD ID: | SEM |
Number of entries in BioLiP: | 1 |
Chemical formula: | C10 H13 N O3 |
InChI: | InChI=1S/C10H13NO3/c11-9(10(12)13)7-14-6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)/t9-/m0/s1 |
InChIKey: | IDGQXGPQOGUGIX-VIFPVBQESA-N |
SMILES: | Software | SMILES |
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ACDLabs 12.01 | O=C(O)C(N)COCc1ccccc1 | CACTVS 3.370 | N[CH](COCc1ccccc1)C(O)=O | CACTVS 3.370 | N[C@@H](COCc1ccccc1)C(O)=O | OpenEye OEToolkits 1.7.0 | c1ccc(cc1)COC[C@@H](C(=O)O)N | OpenEye OEToolkits 1.7.0 | c1ccc(cc1)COCC(C(=O)O)N |
|
Name: | O-benzyl-L-serine; (2S)-2-azanyl-3-phenylmethoxy-propanoic acid |
ZINC: | ZINC000000086010 |