Products 3084147-81-6
CAS 3084147-81-6 is the registry number for OncoACP3. Offered by: MedChemExpress. Available pack sizes: Get quote.
2-[4-[2-[6-[[(2S,4S)-4-[4-[[4-[(benzylamino)-phosphonomethyl]phenoxy]methyl]triazol-1-yl]-1-[2-(dibenzylamino)acetyl]pyrrolidine-2-carbonyl]amino]hexylamino]-2-oxoethyl]-7,10-bis(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid (CAS 3084147-81-6) is a chemical compound with the molecular formula C60H81N12O13P and a molecular weight of 1209.3 g/mol. IUPAC name: 2-[4-[2-[6-[[(2S,4S)-4-[4-[[4-[(benzylamino)-phosphonomethyl]phenoxy]methyl]triazol-1-yl]-1-[2-(dibenzylamino)acetyl]pyrrolidine-2-carbonyl]amino]hexylamino]-2-oxoethyl]-7,10-bis(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid. InChIKey: YPEWASXJDZUDKM-XAKGHLFPSA-N.
| Molecular formula | C60H81N12O13P |
|---|---|
| Molecular weight | 1209.3 g/mol |
| IUPAC name | 2-[4-[2-[6-[[(2S,4S)-4-[4-[[4-[(benzylamino)-phosphonomethyl]phenoxy]methyl]triazol-1-yl]-1-[2-(dibenzylamino)acetyl]pyrrolidine-2-carbonyl]amino]hexylamino]-2-oxoethyl]-7,10-bis(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid |
| InChIKey | YPEWASXJDZUDKM-XAKGHLFPSA-N |
| SMILES | C1CN(CCN(CCN(CCN1CC(=O)NCCCCCCNC(=O)[C@@H]2C[C@@H](CN2C(=O)CN(CC3=CC=CC=C3)CC4=CC=CC=C4)N5C=C(N=N5)COC6=CC=C(C=C6)C(NCC7=CC=CC=C7)P(=O)(O)O)CC(=O)O)CC(=O)O)CC(=O)O |
Computed by PubChem (NCBI)
Synonyms:
orb3136061