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Chemistry

Mol. Mass

477.63

ALogP

1.8

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCC(CC)C(=O)OCOC(=O)C1=C(S[C@H]2CC[S@+]([O-])C2)S[C@@H]3[C@@H]([C@@H](C)O)C(=O)N13
  • InChIKey: NBPVNGWRLGHULH-POPGPGKWSA-N
    InChI=1S/C19H27NO7S3/c1-4-11(5-2)17(23)26-9-27-18(24)14-19(28-12-6-7-30(25)8-12)29-16-13(10(3)21)15(22)20(14)16/h10-13,16,21H,4-9H2,1-3H3/t10-,12+,13+,16-,30+/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2105663   ChEMBL
sulopenem etzadroxil *

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