LEFAMULIN ACETATE

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Trade Names:
Synonyms:
Status: Approved (2019)
Entry Type: Small molecule
Molecule Category: Salt
UNII: HDN0B924X4
Parent Compound: LEFAMULIN

Structure
InChI Key WSMXIQXWHPSVDE-ZPJPNJFZSA-N
Smile C=C[C@]1(C)C[C@@H](OC(=O)CS[C@@H]2CC[C@@H](N)C[C@H]2O)[C@]2(C)[C@H](C)CC[C@]3(CCC(=O)[C@H]32)[C@@H](C)[C@@H]1O.CC(=O)O
InChI
InChI=1S/C28H45NO5S.C2H4O2/c1-6-26(4)14-22(34-23(32)15-35-21-8-7-18(29)13-20(21)31)27(5)16(2)9-11-28(17(3)25(26)33)12-10-19(30)24(27)28;1-2(3)4/h6,16-18,20-22,24-25,31,33H,1,7-15,29H2,2-5H3;1H3,(H,3,4)/t16-,17+,18-,20-,21-,22-,24+,25+,26-,27+,28+;/m1./s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C30H49NO7S
Molecular Weight 567.79
AlogP 3.87
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 5.0
Polar Surface Area 109.85
Molecular species BASE
Aromatic Rings 0.0
Heavy Atoms 35.0

Pharmacology

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

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Pneumonia, Bacterial 4 D018410 FDA

Related Entries

Scaffolds

Parent

Cross References

Resources Reference
ChEMBL CHEMBL3545309
FDA SRS HDN0B924X4
PubChem 86346053
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