Basic information
- CAS
93207-23-9- Standard SMILES
CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(C)C)C(C)C)C(=O)N[C@@H](CC(C)C)C(N)=O- InChIKey
NNALPYMOQMYVDT-PEXFCOMQSA-N- Molecular formula
- C72H135N19O15
- Average molar mass
- 1,507 g/mol
- Monoisotopic mass
- 1,506.03850468
Overview
Mastoparan C has been reported in Vespa crabro with data available.
Names & identifiers
- Preferred name
- Mastoparan C
- IUPAC
- (2S)-N-[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-6-amino-1-[[(2S,3S)-1-[[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-1-oxohexan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]-2-[[(2S)-2-amino-4-methylpentanoyl]amino]butanediamide
- English name
- (2S)-N-[(1S)-1-[[(1S)-5-amino-1-[[(1S)-1-[[(1S)-1-[[(1S)-1-[[(1S)-1-[[ (1S)-1-[[(1S)-1-[[(1S)-5-amino-1-[[(1S)-5-amino-1-[[(1S,2S)-1-[[(1S)-1 -carbamoyl-3-methyl-butyl]carbamoyl]-2-methyl-butyl]carbamoyl]pentyl]c arbamoyl]pentyl]carbamoyl]ethyl]carbamoyl]-2-methyl-propyl]carbamoyl]e thyl]carbamoyl]-3-methyl-butyl]carbamoyl]-3-methyl-butyl]carbamoyl]eth yl]carbamoyl]pentyl]carbamoyl]-3-methyl-butyl]-2-[[(2S)-2-amino-4-meth yl-pentanoyl]amino]butanediamide
- Molecular formula
- C72H135N19O15
- Molecular weight
- 1506.96
Names & synonyms
Mastoparan C93207-23-9Leu-asn-leu-lys-ala-leu-leu-ala-val-ala-lys-lys-ile-leunh2DTXSID00239338Mast cell degranulating peptide (vespula lewisii), 1-L-leucine-7-L-leucine-9-L-valine-RefChem:155967DTXCID20161829(2S)-N-((2S)-1-(((2S)-6-amino-1-(((2S)-1-(((2S)-1-(((2S)-1-(((2S)-1-(((2S)-1-(((2S)-1-(((2S)-6-amino-1-(((2S)-6-amino-1-(((2S,3S)-1-(((2S)-1-amino-4-methyl-1-oxopentan-2-yl)amino)-3-methyl-1-oxopentan-2-yl)amino)-1-oxohexan-2-yl)amino)-1-oxohexan-2-yl)amino)-1-oxopropan-2-yl)amino)-3-methyl-1-oxobutan-2-yl)amino)-1-oxopropan-2-yl)amino)-4-methyl-1-oxopentan-2-yl)amino)-4-methyl-1-oxopentan-2-yl)amino)-1-oxopropan-2-yl)amino)-1-oxohexan-2-yl)amino)-4-methyl-1-oxopentan-2-yl)-2-(((2S)-2-amino-4-methylpentanoyl)amino)butanediamide
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 569 Ų
- Hydrogen bond donors
- 19
- Hydrogen bond acceptors
- 19
- Rotatable bonds
- 54
- Heavy atoms
- 106
- Formal charge
- 0
- Complexity
- 2,840
Physicochemical properties
- Boiling point
- 1675.8 · 1675.8±65.0 °C(Predicted)
- Density
- 1.143 · 1.143±0.06 g/cm3(Predicted)
- pka
- 13.4 · 13.40±0.46(Predicted)
Chemistry & industry
Suppliers3 total
LEON (NANJING) BIOTECHNOLOGY CO., LTD.15051830413 · [email protected]
南京莱昂生物科技有限公司025-84523390 -127; 17705183659 · [email protected]
南京肽业生物科技有限公司025-58361106-805 15951641583 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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