methacycline (rondomycin) Report issue

Small molecule Approved FDA
ChEMBL DrugBank Drug Central Drugs@FDA KEGG MeSH PubChem repoDB

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Chemistry

Mol. Mass

442.42

ALogP

-0.44

Rule of 5

No

Rule of 3

No
Details
  • SMILES: C=C1c2cccc(O)c2C(=O)C2=C(O)[C@]3(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@@H]3[C@@H](O)[C@H]12
  • InChIKey: MHIGBKBJSQVXNH-IWVLMIASSA-N
    InChI=1S/C22H22N2O8/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29/h4-6,10,14-15,17,25,27-29,32H,1H2,2-3H3,(H2,23,31)/t10-,14-,15+,17+,22+/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL249837   ChEMBL
methacycline *

CHEMBL2146123   ChEMBL
methacycline hydrochloride

IR235I7C5P   NCATS
methacycline *

Metacycline   Wikipedia

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