MT-II   Click here for help

GtoPdb Ligand ID: 1323

Synonyms: melanotan II | MTII
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2D Structure
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SMILES / InChI / InChIKey
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Canonical SMILES CCCCC(C(=O)NC1CC(=O)NCCCCC(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC1=O)Cc1[nH]cnc1)Cc1ccccc1)CCCN=C(N)N)Cc1c[nH]c2c1cccc2)C(=O)N)NC(=O)C
Isomeric SMILES CCCC[C@@H](C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC1=O)Cc1[nH]cnc1)Cc1ccccc1)CCCN=C(N)N)Cc1c[nH]c2c1cccc2)C(=O)N)NC(=O)C
InChI InChI=1S/C50H69N15O9/c1-3-4-16-36(59-29(2)66)44(69)65-41-25-42(67)55-20-11-10-18-35(43(51)68)60-47(72)39(23-31-26-57-34-17-9-8-15-33(31)34)63-45(70)37(19-12-21-56-50(52)53)61-46(71)38(22-30-13-6-5-7-14-30)62-48(73)40(64-49(41)74)24-32-27-54-28-58-32/h5-9,13-15,17,26-28,35-41,57H,3-4,10-12,16,18-25H2,1-2H3,(H2,51,68)(H,54,58)(H,55,67)(H,59,66)(H,60,72)(H,61,71)(H,62,73)(H,63,70)(H,64,74)(H,65,69)(H4,52,53,56)/t35-,36-,37-,38+,39-,40-,41-/m0/s1
InChI Key JDKLPDJLXHXHNV-MFVUMRCOSA-N
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Compound class Peptide or derivative
IUPAC Name Click here for help
(3S,6S,9R,12S,15S,23S)-9-benzyl-6-{3-[(diaminomethylidene)amino]propyl}-15-[(2S)-2-acetamidohexanamido]-12-(1H-imidazol-5-ylmethyl)-3-(1H-indol-3-ylmethyl)-2,5,8,11,14,17-hexaoxo-1,4,7,10,13,18-hexaazacyclotricosane-23-carboxamide
Synonyms Click here for help
melanotan II | MTII
Database Links Click here for help
BindingDB Ligand 50184359
ChEMBL Ligand CHEMBL430239
GtoPdb PubChem SID 135652308
PubChem CID 92432
Search Google for chemical match using the InChIKey JDKLPDJLXHXHNV-MFVUMRCOSA-N
Search Google for chemicals with the same backbone JDKLPDJLXHXHNV
Search UniChem for chemical match using the InChIKey JDKLPDJLXHXHNV-MFVUMRCOSA-N
Search UniChem for chemicals with the same backbone JDKLPDJLXHXHNV
Wikipedia Melanotan_II

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Tocris
Melanotan II
Cat. No. 2566