M1L
2-({[(3E)-5-{4-[(DIMETHYLAMINO)(DIHYDROXY)-LAMBDA~4~-SULFANYL]PHENYL}-8-METHYL-2-OXO-6,7,8,9-TETRAHYDRO-1H-PYRROLO[3,2-H]ISOQUINOLIN-3(2H)-YLIDENE]AMINO}OXY)-4-HYDROXYBUTANOIC ACID
Find entries where: M1L
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | 2-({[(3E)-5-{4-[(DIMETHYLAMINO)(DIHYDROXY)-LAMBDA~4~-SULFANYL]PHENYL}-8-METHYL-2-OXO-6,7,8,9-TETRAHYDRO-1H-PYRROLO[3,2-H]ISOQUINOLIN-3(2H)-YLIDENE]AMINO}OXY)-4-HYDROXYBUTANOIC ACID |
Synonyms | SPD 502; NS 1209 |
Identifiers | n/a |
Formula | C24 H30 N4 O7 S |
Molecular Weight | 518.583 |
Type | NON-POLYMER |
Isomeric SMILES | CN1CCc2c(cc\3c(c2C1)NC(=O)/C3=N/O[C@@H](CCO)C(=O)O)c4ccc(cc4)S(N(C)C)(O)O |
InChI | InChI=1S/C24H30N4O7S/c1-27(2)36(33,34)15-6-4-14(5-7-15)17-12-18-21(19-13-28(3)10-8-16(17)19)25-23(30)22(18)26-35-20(9-11-29)24(31)32/h4-7,12,20,29,33-34H,8-11,13H2,1-3H3,(H,31,32)(H,25,26,30)/t20-/m0/s1 |
InChIKey | PHWIDOUZQOKACD-FQEVSTJZSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 66 |
Chiral Atom Count | 1 |
Bond Count | 69 |
Aromatic Bond Count | 13 |
Related Resource References
Resource Name | Reference |
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PubChem | 135412780, 135574455, 10062733, 139033486 |