Mast Cell Degranulating Peptide (Vespa Basalis)
[CAS# 137354-65-5]

Identification

• Name: Mast Cell Degranulating Peptide (Vespa Basalis)
• Synonyms: Mastoparan B
• Molecular Formula: C₇₈H₁₃₈N₂₀O₁₆
• Molecular Weight: 1612.07
• CAS Registry Number: 137354-65-5
• SMILES: [C@@H](C(N[C@H](C(N[C@H](C(=O)N[C@H](C(N[C@@H](CO)C(N[C@H](C(=O)N[C@H](C(N[C@H](C(N[C@@H](CC1=C[NH]C2=C1C=CC=C2)C(=O)N[C@H](C(=O)N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N)=O)CC(C)C)=O)C(C)C)=O)CCCCN)=O)CCCCN)C)=O)CO)=O)C(C)C)[C@H](CC)C)=O)=O)CCCCN)CC(C)C)=O)CCCCN)=O)(N)CC(C)C
• InChI: 1S/C78H138N20O16/c1-14-47(12)64(98-75(111)61(41-100)94-70(106)55(29-19-23-33-81)90-73(109)58(37-44(6)7)92-69(105)54(28-18-22-32-80)88-67(103)51(83)35-42(2)3)78(114)97-63(46(10)11)77(113)95-60(40-99)74(110)93-59(38-49-39-85-52-26-16-15-25-50(49)52)72(108)86-48(13)66(102)87-53(27-17-21-31-79)68(104)89-56(30-20-24-34-82)71(107)96-62(45(8)9)76(112)91-57(65(84)101)36-43(4)5/h15-16,25-26,39,42-48,51,53-64,85,99-100H,14,17-24,27-38,40-41,79-83H2,1-13H3,(H2,84,101)(H,86,108)(H,87,102)(H,88,103)(H,89,104)(H,90,109)(H,91,112)(H,92,105)(H,93,110)(H,94,106)(H,95,113)(H,96,107)(H,97,114)(H,98,111)/t47-,48-,51+,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-/m0/s1
• InChIKey: NSFBOCKFBVQQKB-LTKSBDBTSA-N

Properties

• Density: 1.189g/cm³ (Cal.)
• Boiling point: 1779.662°C at 760 mmHg (Cal.)
• Flash point: 1030.102°C (Cal.)