§ 2
For laboratory research use only. Not for human or animal consumption.
Josef Reischig · CC BY 3.0
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BPC-157
Identity
| Field | Value |
|---|---|
| IUPAC name | (4S)-4-[(2-aminoacetyl)amino]-5-[(2S)-2-[(2S)-2-[(2S)-2-[[2-[[6-amino-1-[(2S)-2-[[(2S)-1-[[(2S)-3-carboxy-1-[[(2S)-3-carboxy-1-[[(2S)-1-[[2-[[(2S)-1-[[(1S)-1-carboxy-2-methylpropyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxohexan-2-yl]amino]-2-oxoethyl]carbamoyl]pyrrolidine-1-carbonyl]pyrrolidine-1-carbonyl]pyrrolidin-1-yl]-5-oxopentanoic acid |
| SMILES | C[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)C(CCCCN)NC(=O)CNC(=O)[C@@H]2CCCN2C(=O)[C@@H]3CCCN3C(=O)[C@@H]4CCCN4C(=O)[C@H](CCC(=O)O)NC(=O)CN |
| InChI | InChI=1S/C62H98N16O22/c1-31(2)25-37(55(92)74-50(32(3)4)62(99)100)71-46(81)29-65-51(88)33(5)67-53(90)38(26-48(84)85)73-54(91)39(27-49(86)87)72-52(89)34(6)68-57(94)41-15-10-21-75(41)58(95)35(13-7-8-20-63)70-45(80)30-66-56(93)40-14-9-22-76(40)60(97)43-17-12-24-78(43)61(98)42-16-11-23-77(42)59(96)36(18-19-47(82)83)69-44(79)28-64/h31-43,50H,7-30,63-64H2,1-6H3,(H,65,88)(H,66,93)(H,67,90)(H,68,94)(H,69,79)(H,70,80)(H,71,81)(H,72,89)(H,73,91)(H,74,92)(H,82,83)(H,84,85)(H,86,87)(H,99,100)/t33-,34-,35?,36-,37-,38-,39-,40-,41-,42-,43-,50-/m0/s1 |
| InChIKey | HEEWEZGQMLZMFE-DGQLYNSISA-N |
Chemistry
| Field | Value |
|---|---|
| Compound class | Pentadecapeptide (15 aa) |
| Formula | C₆₂H₉₈N₁₆O₂₂ |
| Molecular weight | 1419.56 |
| CAS | 137525-51-0 |
| PubChem | PubChem CID 108101 (opens in a new tab) |
2D structure
3D structure
Computed conformer: one plausible shape of a flexible molecule, not a measured structure · RDKit
Additional properties
| Property | Value |
|---|---|
| Exact mass | 1418.70415882 Da |
| Monoisotopic mass | 1418.70415882 Da |
| XLogP3 | -9 |
| Topological polar surface area | 573 Ų |
| Hydrogen bond donors | 16 |
| Hydrogen bond acceptors | 24 |
| Rotatable bonds | 39 |
| Heavy atoms | 100 |
Sources
| Source | Kind | Retrieved |
|---|---|---|
Computed conformer (RDKit ETKDGv3 + MMFF94) | Internal | Oct 12, 2026 |
PubChem | Oct 12, 2026 |
Products containing this compound
| Product | Milligrams |
|---|---|
entire fill | |
10 mg | |
10 mg |