STAVUDINE GLUCURONIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H20N2O10
Molecular Weight	400.3374
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=CN([C@@H]2O[C@H](CO[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)C=C2)C(=O)NC1=O

InChI

InChIKey=OMYGFARMZNCWPN-VPAGTZFPSA-N

InChI=1S/C16H20N2O10/c1-6-4-18(16(25)17-13(6)22)8-3-2-7(27-8)5-26-15-11(21)9(19)10(20)12(28-15)14(23)24/h2-4,7-12,15,19-21H,5H2,1H3,(H,23,24)(H,17,22,25)/t7-,8+,9-,10-,11+,12-,15+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C16H20N2O10
Molecular Weight	400.3374
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:09:38 UTC 2023` Edited by `admin` on `Sat Dec 16 10:09:38 UTC 2023`
Record UNII	X4PT8NAI8E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

STAVUDINE GLUCURONIDE

Common Name

English

(2S,3S,4S,5R,6R)-3,4,5-TRIHYDROXY-6-(((2S,5R)-5-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)-2,5-DIHYDROFURAN-2-YL)METHOXY)TETRAHYDRO-2H-PYRAN-2-CARBOXYLIC ACID

Systematic Name

English

STAVUDINE (M3)

Common Name

English

Code System Code Type Description

FDA UNII

X4PT8NAI8E

Created by admin on Sat Dec 16 10:09:38 UTC 2023 , Edited by admin on Sat Dec 16 10:09:38 UTC 2023

PRIMARY

PUBCHEM

91800238

Created by admin on Sat Dec 16 10:09:38 UTC 2023 , Edited by admin on Sat Dec 16 10:09:38 UTC 2023

PRIMARY

Related Record Type Details


					BO9LE4QFZF

STAVUDINE

PARENT -> METABOLITE

Interaction Type:

MINOR

Qualification:

URINE

Amount: