Products 3029912-63-5
CAS 3029912-63-5 is the registry number for Cbl-b-IN-31. Offered by: MedChemExpress. Available pack sizes: Get quote.
(4S)-4-[[(2S)-1-[(2S,3R)-2-[[(2S)-2-[[(2S)-2-acetamido-5-(diaminomethylideneamino)pentanoyl]amino]-3-(4-phosphonooxyphenyl)propanoyl]amino]-3-hydroxybutanoyl]pyrrolidine-2-carbonyl]amino]-5-[(2S)-2-carbamoylpyrrolidin-1-yl]-5-oxopentanoic acid (CAS 3029912-63-5) is a chemical compound with the molecular formula C36H55N10O14P and a molecular weight of 882.9 g/mol. IUPAC name: (4S)-4-[[(2S)-1-[(2S,3R)-2-[[(2S)-2-[[(2S)-2-acetamido-5-(diaminomethylideneamino)pentanoyl]amino]-3-(4-phosphonooxyphenyl)propanoyl]amino]-3-hydroxybutanoyl]pyrrolidine-2-carbonyl]amino]-5-[(2S)-2-carbamoylpyrrolidin-1-yl]-5-oxopentanoic acid. InChIKey: IBEMHLFJQQTJII-FLRWUIOGSA-N.
| Molecular formula | C36H55N10O14P |
|---|---|
| Molecular weight | 882.9 g/mol |
| IUPAC name | (4S)-4-[[(2S)-1-[(2S,3R)-2-[[(2S)-2-[[(2S)-2-acetamido-5-(diaminomethylideneamino)pentanoyl]amino]-3-(4-phosphonooxyphenyl)propanoyl]amino]-3-hydroxybutanoyl]pyrrolidine-2-carbonyl]amino]-5-[(2S)-2-carbamoylpyrrolidin-1-yl]-5-oxopentanoic acid |
| InChIKey | IBEMHLFJQQTJII-FLRWUIOGSA-N |
| SMILES | C[C@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N2CCC[C@H]2C(=O)N)NC(=O)[C@H](CC3=CC=C(C=C3)OP(=O)(O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)C)O |
Computed by PubChem (NCBI)
Synonyms:
orb3180563