BAL-19764

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H16N6O9S2
Molecular Weight	488.452
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@H]1[C@H](NC(=O)C(=N/OCC2=CC(=O)C(O)=CN2O)\C3=CSC(N)=N3)C(=O)N1S(O)(=O)=O

InChI

InChIKey=UUGRTBCTVUNWTN-DLRIENLKSA-N

InChI=1S/C15H16N6O9S2/c1-6-11(14(25)21(6)32(27,28)29)18-13(24)12(8-5-31-15(16)17-8)19-30-4-7-2-9(22)10(23)3-20(7)26/h2-3,5-6,11,23,26H,4H2,1H3,(H2,16,17)(H,18,24)(H,27,28,29)/b19-12-/t6-,11-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C15H16N6O9S2
Molecular Weight	488.452
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:16:29 GMT 2023` Edited by `admin` on `Sat Dec 16 08:16:29 GMT 2023`
Record UNII	9YYX84C6B7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BAL-19764

Code

English

PTX-2416

Code

English

1-AZETIDINESULFONIC ACID, 3-(((2Z)-2-(2-AMINO-4-THIAZOLYL)-2-(((1,4-DIHYDRO-1,5-DIHYDROXY-4-OXO-2-PYRIDINYL)METHOXY)IMINO)ACETYL)AMINO)-2-METHYL-4-OXO-, (2S,3S)-

Systematic Name

English

SYN-2416

Code

English

BAL19764

Code

English

(2S,3S)-3-(((2Z)-2-(2-AMINO-4-THIAZOLYL)-2-(((1,4-DIHYDRO-1,5-DIHYDROXY-4-OXO-2-PYRIDINYL)METHOXY)IMINO)ACETYL)AMINO)-2-METHYL-4-OXO-1-AZETIDINESULFONIC ACID

Systematic Name

English

Code System Code Type Description

PUBCHEM

9806439

Created by admin on Sat Dec 16 08:16:29 GMT 2023 , Edited by admin on Sat Dec 16 08:16:29 GMT 2023

PRIMARY

CAS

404824-79-9

Created by admin on Sat Dec 16 08:16:29 GMT 2023 , Edited by admin on Sat Dec 16 08:16:29 GMT 2023

PRIMARY

FDA UNII

9YYX84C6B7

Created by admin on Sat Dec 16 08:16:29 GMT 2023 , Edited by admin on Sat Dec 16 08:16:29 GMT 2023

PRIMARY

Related Record Type Details


					9YYX84C6B7

BAL-19764

ACTIVE MOIETY