DIRITHROMYCIN

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Trade Names
Synonyms
Status
Molecule Category Free-form
ATC J01FA13
UNII 1801D76STL

Structure

InChI Key WLOHNSSYAXHWNR-DWIOZXRMSA-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@@H]2N[C@@H](COCCOC)O[C@H]([C@H]2C)[C@]1(C)O
InChI
InChI=1S/C42H78N2O14/c1-15-29-42(10,49)37-24(4)32(43-30(56-37)21-52-17-16-50-13)22(2)19-40(8,48)36(58-39-33(45)28(44(11)12)18-23(3)53-39)25(5)34(26(6)38(47)55-29)57-31-20-41(9,51-14)35(46)27(7)54-31/h22-37,39,43,45-46,48-49H,15-21H2,1-14H3/t22-,23-,24+,25+,26-,27+,28+,29-,30-,31+,32+,33-,34+,35+,36-,37-,39+,40-,41-,42-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C42H78N2O14
Molecular Weight 835.09
AlogP 2.2
Hydrogen Bond Acceptor 16.0
Hydrogen Bond Donor 5.0
Number of Rotational Bond 12.0
Polar Surface Area 196.33
Molecular species BASE
Aromatic Rings 0.0
Heavy Atoms 58.0

Pharmacology

Mechanism of Action Action Reference
Bacterial 70S ribosome inhibitor INHIBITOR PubMed PubMed PubMed

Cross References

Resources Reference
ChEBI 474014
ChEMBL CHEMBL1237072
DrugBank DB00954
DrugCentral 925
FDA SRS 1801D76STL
PDB DI0
PubChem 6473883
ZINC ZINC000096095661
CONTENTS