SB-217452

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H24N6O9S
Molecular Weight	476.462
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1C(=O)N(C=C\C1=N/C(N)=O)[C@@H]2S[C@H]([C@@H](O)[C@@H](NC(=O)[C@@H](N)CO)C(O)=O)[C@H](O)[C@H]2O

InChI

InChIKey=NGJDTPRGDCKRHD-DWRMSLKJSA-N

InChI=1S/C16H24N6O9S/c1-21-6(19-15(18)30)2-3-22(16(21)31)13-10(26)9(25)11(32-13)8(24)7(14(28)29)20-12(27)5(17)4-23/h2-3,5,7-11,13,23-26H,4,17H2,1H3,(H2,18,30)(H,20,27)(H,28,29)/b19-6+/t5-,7+,8-,9+,10+,11+,13+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C16H24N6O9S
Molecular Weight	476.462
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:59:40 GMT 2025` Edited by `admin` on `Mon Mar 31 20:59:40 GMT 2025`
Record UNII	36HW38MMIN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SB-217452

Common Name

English

L-GLYCERO-.ALPHA.-L-IDO-HEPTOFURANURONIC ACID, 1-(4-((AMINOCARBONYL)IMINO)-3,4-DIHYDRO-3-METHYL-2-OXO-1(2H)-PYRIMIDINYL)-6-(((2S)-2-AMINO-3-HYDROXY-1-OXOPROPYL)AMINO)-1,6-DIDEOXY-4-THIO-

Preferred Name

English

Code System Code Type Description

FDA UNII

36HW38MMIN

Created by admin on Mon Mar 31 20:59:40 GMT 2025 , Edited by admin on Mon Mar 31 20:59:40 GMT 2025

PRIMARY

PUBCHEM

90479041

Created by admin on Mon Mar 31 20:59:40 GMT 2025 , Edited by admin on Mon Mar 31 20:59:40 GMT 2025

PRIMARY

CAS

93301-58-7

Created by admin on Mon Mar 31 20:59:40 GMT 2025 , Edited by admin on Mon Mar 31 20:59:40 GMT 2025

PRIMARY