Products 2994332-18-0

CAS 2994332-18-0 appears in our catalog under these names: DBCO-Val-Cit-PABC-PNP 98%, DBCO-Val-Cit-PABC-PNP, 97.74%. Offered by: Ambeed, MedChemExpress. Available pack sizes: 5mg, 10mg, 25mg, 50mg, 100mg, 100 mg, 5 mg, 10 mg.

Structural formula: {0} (CAS {1})

[4-[[(2S)-2-[[(2S)-2-[[6-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-6-oxohexanoyl]amino]-3-methylbutanoyl]amino]-5-(carbamoylamino)pentanoyl]amino]phenyl]methyl (4-nitrophenyl) carbonate (CAS 2994332-18-0) is a chemical compound with the molecular formula C46H49N7O10 and a molecular weight of 859.9 g/mol. IUPAC name: [4-[[(2S)-2-[[(2S)-2-[[6-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-6-oxohexanoyl]amino]-3-methylbutanoyl]amino]-5-(carbamoylamino)pentanoyl]amino]phenyl]methyl (4-nitrophenyl) carbonate. InChIKey: RJGJTFMRBABKDS-PIFUBOJPSA-N.

Identity
Molecular formulaC46H49N7O10
Molecular weight859.9 g/mol
IUPAC name[4-[[(2S)-2-[[(2S)-2-[[6-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-6-oxohexanoyl]amino]-3-methylbutanoyl]amino]-5-(carbamoylamino)pentanoyl]amino]phenyl]methyl (4-nitrophenyl) carbonate
InChIKeyRJGJTFMRBABKDS-PIFUBOJPSA-N
SMILESCC(C)[C@@H](C(=O)N[C@@H](CCCNC(=O)N)C(=O)NC1=CC=C(C=C1)COC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)CCCCC(=O)N3CC4=CC=CC=C4C#CC5=CC=CC=C53

Computed by PubChem (NCBI)