SULTAMICILLIN

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: J01CR04
UNII: 65DT0ML581

Structure
InChI Key OPYGFNJSCUDTBT-PMLPCWDUSA-N
Smile CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C
InChI
InChI=1S/C25H30N4O9S2/c1-24(2)17(29-20(32)16(21(29)39-24)27-19(31)15(26)12-8-6-5-7-9-12)22(33)37-11-38-23(34)18-25(3,4)40(35,36)14-10-13(30)28(14)18/h5-9,14-18,21H,10-11,26H2,1-4H3,(H,27,31)/t14-,15-,16-,17+,18+,21-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C25H30N4O9S2
Molecular Weight 594.67
AlogP -0.59
Hydrogen Bond Acceptor 11.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 7.0
Polar Surface Area 182.48
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 40.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 76497-13-7
ChEBI 51770
ChEMBL CHEMBL506110
DrugBank DB12127
DrugCentral 2539
FDA SRS 65DT0ML581
PubChem 444022
SureChEMBL SCHEMBL34392
ZINC ZINC000042834847
CONTENTS