Igercine
[CAS# 92891-56-0]

Identification

• Name: Igercine
• Synonyms: (2S)-6-Amino-2-[[2-[[(2S)-1-[(2S)-4-Amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-Amino-5-Guanidino-Pentanoyl]Amino]Propanoyl]Amino]-3-Methyl-Butanoyl]Amino]-3-Hydroxy-Propanoyl]Amino]-3-Methyl-Butanoyl]Amino]-4-Oxo-Butanoyl]Pyrrolidine-2-Carbonyl]
• Molecular Formula: C₃₉H₇₀N₁₄O₁₂
• Molecular Weight: 927.07
• CAS Registry Number: 92891-56-0
• SMILES: [C@@H]1(N(CCC1)C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCCN=C(N)N)C)C(C)C)CO)C(C)C)CC(=O)N)C(=O)NCC(=O)N[C@@H](CCCCN)C(O)=O
• InChI: 1S/C39H70N14O12/c1-19(2)29(51-31(57)21(5)47-32(58)22(41)10-8-14-45-39(43)44)36(62)50-25(18-54)33(59)52-30(20(3)4)35(61)49-24(16-27(42)55)37(63)53-15-9-12-26(53)34(60)46-17-28(56)48-23(38(64)65)11-6-7-13-40/h19-26,29-30,54H,6-18,40-41H2,1-5H3,(H2,42,55)(H,
• InChIKey: FLRLYDYDLREVOO-QBUMULATSA-N

Properties

• Density: 1.485g/cm³ (Cal.)