N⁵-(Diaminomethylene)ornithylglycyl-alpha-aspartylserylprolylalanylserylseryllysylproline
[CAS# 91575-25-6]

Identification

• Name: N⁵-(Diaminomethylene)ornithylglycyl-alpha-aspartylserylprolylalanylserylseryllysylproline
• Synonyms: ARG-GLY-ASP-SER-PRO-ALA-SER-SER-LYS-PRO; A6677_SIGMA
• Molecular Formula: C₄₀H₆₈N₁₄O₁₆
• Molecular Weight: 1001.05
• CAS Registry Number: 91575-25-6
• SMILES: O=C(O)C2N(C(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C1N(C(=O)C(NC(=O)C(NC(=O)CNC(=O)C(N)CCC/N=C(\N)N)CC(=O)O)CO)CCC1)C)CO)CO)CCCCN)CCC2
• InChI: 1S/C40H68N14O16/c1-20(31(61)50-24(17-55)35(65)51-25(18-56)34(64)49-22(8-2-3-11-41)37(67)54-14-6-10-28(54)39(69)70)47-36(66)27-9-5-13-53(27)38(68)26(19-57)52-33(63)23(15-30(59)60)48-29(58)16-46-32(62)21(42)7-4-12-45-40(43)44/h20-28,55-57H,2-19,41-42H2,1H3,(H,46,62)(H,47,66)(H,48,58)(H,49,64)(H,50,61)(H,51,65)(H,52,63)(H,59,60)(H,69,70)(H4,43,44,45)
• InChIKey: JMBLPSUDFRAOLU-UHFFFAOYSA-N

Properties

• Density: 1.619g/cm³ (Cal.)