Diphenylmethyl 3-[(5RS)-2,5-dihydro-2-oxofuran-5-yl methyl]-7beta-phenylacetamidoceph-3-em-4-carboxylate

HCID 70366830
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Basic information

Standard SMILES
O=C(Cc1ccccc1)N[C@@H]1C(=O)N2C(C(=O)OC(c3ccccc3)c3ccccc3)=C(CC3C=CC(=O)O3)CS[C@H]12
InChIKey
DVUOYEDMHXTLBU-ZXVOXEBXSA-N
Molecular formula
C33H28N2O6S
Average molar mass
580.7 g/mol
Monoisotopic mass
580.16680779

Names & identifiers

Preferred name
Diphenylmethyl 3-[(5RS)-2,5-dihydro-2-oxofuran-5-yl methyl]-7beta-phenylacetamidoceph-3-em-4-carboxylate
IUPAC
benzhydryl (6R,7R)-8-oxo-3-[(5-oxo-2H-furan-2-yl)methyl]-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Names & synonyms

SCHEMBL10437192DVUOYEDMHXTLBU-ZXVOXEBXSA-NDiphenylmethyl 3-[(5RS)-2,5-dihydro-2-oxofuran-5-yl methyl]-7beta-phenylacetamidoceph-3-em-4-carboxylate

Database identifiers

PubChem CID
70366830

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
127 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
10
Heavy atoms
42

Related reactions

1 records
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Compound notes

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