U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H31N5O8S2
Molecular Weight 617.694
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OZOLAMIDE OF 6-APA DIMER

SMILES

[H][C@@](NC(=O)C1=C(C)ON=C1C2=CC=CC=C2)(C(=O)N[C@@H]3C(=O)N4[C@@H](C(O)=O)C(C)(C)S[C@]34[H])[C@]5([H])N[C@@H](C(O)=O)C(C)(C)S5

InChI

InChIKey=VPSGOHMBUXSFMC-KCPUJOARSA-N
InChI=1S/C27H31N5O8S2/c1-11-13(14(31-40-11)12-9-7-6-8-10-12)19(33)28-15(21-30-17(24(36)37)26(2,3)41-21)20(34)29-16-22(35)32-18(25(38)39)27(4,5)42-23(16)32/h6-10,15-18,21,23,30H,1-5H3,(H,28,33)(H,29,34)(H,36,37)(H,38,39)/t15-,16-,17+,18+,21-,23-/m1/s1

HIDE SMILES / InChI

Molecular Formula C27H31N5O8S2
Molecular Weight 617.694
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:41:13 GMT 2023
Edited
by admin
on Sat Dec 16 10:41:13 GMT 2023
Record UNII
39UU58R6KU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OZOLAMIDE OF 6-APA DIMER
Common Name English
OXACILLIN SODIUM MONOHYDRATE IMPURITY J [EP IMPURITY]
Common Name English
(2S,5R,6R)-6-(((2R)-((2R,4S)-4-CARBOXY-5,5-DIMETHYLTHIAZOLIDIN-2-YL)(((5-METHYL-3-PHENYLISOXAZOL-4-YL)CARBONYL)AMINO)ACETYL)AMINO)-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID
Common Name English
Code System Code Type Description
PUBCHEM
139024605
Created by admin on Sat Dec 16 10:41:13 GMT 2023 , Edited by admin on Sat Dec 16 10:41:13 GMT 2023
PRIMARY
FDA UNII
39UU58R6KU
Created by admin on Sat Dec 16 10:41:13 GMT 2023 , Edited by admin on Sat Dec 16 10:41:13 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP