Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L4Q2FX
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| Ligand Name |
3(S)-Methylcarbamoyl-7-sulfoamino-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester
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| Synonyms |
3(S)-METHYLCARBAMOYL-7-SULFOAMINO-3,4-DIHYDRO-1H-ISOQUINOLINE-2-CARBOXYLIC ACID TERT-BUTYL ESTER; 2f6t; 1C2; CHEMBL203517; SCHEMBL6393832; BDBM13433; DB06887; Tetrahydroisoquinoline (TIQ) deriv. 3; Q27095793; [(3S)-3-(Methylcarbamoyl)-2-{[(2-methyl-2-propanyl)oxy]carbonyl}-1,2,3,4-tetrahydro-7-isoquinolinyl]sulfamic acid; N-[(3S)-2-[(tert-butoxy)carbonyl]-3-(methylcarbamoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]sulfamic acid
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| Structure |
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Download2D MOL |
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| Formula |
C16H23N3O6S
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| Canonical SMILES |
CC(C)(C)OC(=O)N1CC2=C(CC1C(=O)NC)C=CC(=C2)NS(=O)(=O)O
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| InChI |
1S/C16H23N3O6S/c1-16(2,3)25-15(21)19-9-11-7-12(18-26(22,23)24)6-5-10(11)8-13(19)14(20)17-4/h5-7,13,18H,8-9H2,1-4H3,(H,17,20)(H,22,23,24)/t13-/m0/s1
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| InChIKey |
PPSSYXOFPICMQD-ZDUSSCGKSA-N
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| PubChem Compound ID | ||||
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