0ZQ/PRD_000383
BOC-PHE-PSI[CH2CH2NH]-PHE-GLU-PHE-NH2
0ZQ/PRD_000383 is described in the Biologically Interesting Molecule Reference Dictionary (BIRD).
The representative PDB ID is 1LZQ.
Find entries where PRD_000383 is present
Chemical Component Summary | |
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Name | BOC-PHE-PSI[CH2CH2NH]-PHE-GLU-PHE-NH2 |
Identifiers | (4S)-5-[[(2S)-1-azanyl-1-oxo-3-phenyl-propan-2-yl]amino]-4-[[(2S)-2-[[(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-phenyl-butyl]amino]-3-phenyl-propanoyl]amino]-5-oxo-pentanoic acid |
Formula | C38 H49 N5 O7 |
Molecular Weight | 687.825 |
Type | PEPTIDE-LIKE |
Isomeric SMILES | CC(C)(C)OC(=O)N[C@H](CCN[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N)Cc3ccccc3 |
InChI | InChI=1S/C38H49N5O7/c1-38(2,3)50-37(49)41-29(23-26-13-7-4-8-14-26)21-22-40-32(25-28-17-11-6-12-18-28)36(48)42-30(19-20-33(44)45)35(47)43-31(34(39)46)24-27-15-9-5-10-16-27/h4-18,29-32,40H,19-25H2,1-3H3,(H2,39,46)(H,41,49)(H,42,48)(H,43,47)(H,44,45)/t29-,30+,31+,32+/m1/s1 |
InChIKey | CBWQRQVEXJTNOT-ZLESDFJESA-N |
Composition | Polymer Sequences: BOC-Q00-GLU-PHE-NH2 |
BIRD class | INHIBITOR |
Represented As | SINGLE MOLECULE |
Compound Details | n/a |
Description | n/a |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 99 |
Chiral Atom Count | 4 |
Bond Count | 101 |
Aromatic Bond Count | 18 |
Related Resource References
Resource Name | Reference |
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PubChem | 447028 |
ChEMBL | CHEMBL215431 |