ERYTHROMYCIN

/static/temp/default.svg Search structure
Trade Names
Synonyms
Status
Molecule Category Free-form
ATC D10AF02 J01FA01 S01AA17
UNII 63937KV33D
EPA CompTox DTXSID4022991

Structure

InChI Key ULGZDMOVFRHVEP-RWJQBGPGSA-N
Smiles CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O
InChI
InChI=1S/C37H67NO13/c1-14-25-37(10,45)30(41)20(4)27(39)18(2)16-35(8,44)32(51-34-28(40)24(38(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26/h18-26,28-32,34,40-42,44-45H,14-17H2,1-13H3/t18-,19-,20+,21+,22-,23+,24+,25-,26+,28-,29+,30-,31+,32-,34+,35-,36-,37-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C37H67NO13
Molecular Weight 733.94
AlogP 1.79
Hydrogen Bond Acceptor 14.0
Hydrogen Bond Donor 5.0
Number of Rotational Bond 7.0
Polar Surface Area 193.91
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 51.0

Metabolites Network

visNetwork

Pharmacology

Mechanism of Action Action Reference
Bacterial 70S ribosome inhibitor INHIBITOR PubMed DailyMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Cytochrome P450 Cytochrome P450 family 3 Cytochrome P450 family 3A Cytochrome P450 3A4
- 190 - - 45
Ion channel Voltage-gated ion channel Potassium channels Voltage-gated potassium channel
- 39 - - 27-90
Membrane receptor Family A G protein-coupled receptor Peptide receptor (family A GPCR) Short peptide receptor (family A GPCR) Motilin receptor
50.12-630.96 43.65-70.79 - - -
Other cytosolic protein
- 170-760 11-29 - 52
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - -19-92.42
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC22 family of organic cation and anion transporters
- - - - 14
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC47 family of multidrug and toxin extrusion transporters
- - - - 7
Transporter Primary active transporter ATP-binding cassette ABCB subfamily
- - - - 1
Unclassified protein
- 170-760 11-29 - 52-101
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Bacillus subtilis
- 420 - - -
Cricetulus griseus
- - - - 75.85-92.42
Escherichia coli
- 80-900 - - 30-101
Escherichia coli BL21
- 760 11 - -
Escherichia coli K-12
- - 15 - -
Homo sapiens
50.12-630.96 39-190 - - -32-90
Micrococcus luteus
- 310 - - -
Mus musculus
- - - - 42
Oryctolagus cuniculus
316.23 - - - -
Propionibacterium acnes
- 170 29 - 52
Pseudomonas aeruginosa
- - - - 45.7
Raoultella planticola
- 350 - - -
Staphylococcus aureus
- 250 - - -
Streptococcus pneumoniae
- 37-120 - - -

Related Entries

Environmental Exposure

Environmental Exposure Map
Countries
Croatia
Czech Republic
Germany
Hungary
Romania
Serbia
Slovakia
Slovenia
South Africa
Vietnam

Cross References

Resources Reference
ChEBI 42355
ChEMBL CHEMBL532
DrugBank DB00199
DrugCentral 1048
FDA SRS 63937KV33D
Guide to Pharmacology 1456
KEGG C01912
PDB ERY
PharmGKB PA449493
PubChem 12560
SureChEMBL SCHEMBL2601
ZINC ZINC000085534336
CONTENTS