DALFOPRISTIN

Search structure
Synonyms:
Status: Approved (1999)
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: R9M4FJE48E

Structure
InChI Key SUYRLXYYZQTJHF-VMBLUXKRSA-N
Smile CCN(CC)CCS(=O)(=O)[C@@H]1CCN2C(=O)c3coc(n3)CC(=O)C[C@H](O)/C=C(C)/C=C/CNC(=O)/C=C/[C@@H](C)[C@@H](C(C)C)OC(=O)[C@@H]12
InChI
InChI=1S/C34H50N4O9S/c1-7-37(8-2)16-17-48(44,45)28-13-15-38-31(28)34(43)47-32(22(3)4)24(6)11-12-29(41)35-14-9-10-23(5)18-25(39)19-26(40)20-30-36-27(21-46-30)33(38)42/h9-12,18,21-22,24-25,28,31-32,39H,7-8,13-17,19-20H2,1-6H3,(H,35,41)/b10-9+,12-11+,23-18+/t24-,25-,28-,31-,32-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C34H50N4O9S
Molecular Weight 690.86
AlogP 2.27
Hydrogen Bond Acceptor 11.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 7.0
Polar Surface Area 176.42
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 48.0

Pharmacology

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

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Osteomyelitis 0 D010019 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 4309
ChEMBL CHEMBL1200937
DrugBank DB01764
EPA CompTox DTXSID10869549
FDA SRS R9M4FJE48E
Guide to Pharmacology 10797
PDB DOL
PubChem 6323289
SureChEMBL SCHEMBL40993
ZINC ZINC000003917540
CONTENTS