Chemical Property of Somatostatin, azidonitrobenzoyl-lys(9)-iodo-tyr(11)-
Chemical Property:
- XLogP3:-0.8
- Hydrogen Bond Donor Count:23
- Hydrogen Bond Acceptor Count:29
- Rotatable Bond Count:29
- Exact Mass:1842.72426006
- Heavy Atom Count:130
- Complexity:3890
- Purity/Quality:
-
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
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Useful:
- Canonical SMILES:CC(C1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)CCCCNC(=O)C2=C(C=CC(=C2)N=[N+]=[N-])[N+](=O)[O-])CC3=CNC4=CC=CC=C43)CC5=CC=CC=C5)CC6=CC=CC=C6)CC(=O)N)CCCCN)NC(=O)CNC(=O)C(C)N)C(=O)O)CO)C(C)O)CC7=CC=C(C=C7)O)O
- Isomeric SMILES:C[C@H](C1C(=O)N[C@H](C(=O)NC(C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCCCNC(=O)C2=C(C=CC(=C2)N=[N+]=[N-])[N+](=O)[O-])CC3=CNC4=CC=CC=C43)CC5=CC=CC=C5)CC6=CC=CC=C6)CC(=O)N)CCCCN)NC(=O)CNC(=O)[C@H](C)N)C(=O)O)CO)[C@@H](C)O)CC7=CC=C(C=C7)O)O
