METESIND GLUCURONATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H24N4O3S.C6H10O7
Molecular Weight	630.666
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)C(O)=O.CN(CC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)C3=CC=C4N=C(N)C5=CC=CC3=C45

InChI

InChIKey=WGYHOPIXAFLRPR-LRDBBFHQSA-N

InChI=1S/C23H24N4O3S.C6H10O7/c1-26(21-10-9-20-22-18(21)3-2-4-19(22)23(24)25-20)15-16-5-7-17(8-6-16)31(28,29)27-11-13-30-14-12-27;7-1-2(8)3(9)4(10)5(11)6(12)13/h2-10H,11-15H2,1H3,(H2,24,25);1-5,8-11H,(H,12,13)/t;2-,3+,4-,5-/m.0/s1

HIDE SMILES / InChI

Molecular Formula	C23H24N4O3S
Molecular Weight	436.527
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C6H10O7
Molecular Weight	194.1394
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:31:27 UTC 2023` Edited by `admin` on `Fri Dec 15 15:31:27 UTC 2023`
Record UNII	8EC044476N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

METESIND GLUCURONATE

Official Name

English

AG-331

Code

English

4-((.ALPHA.-((2-AMINOBENZ(CD)INDOL-6-YL)METHYLAMINO)-P-TOLYL)SULFONYL)MORPHOLINE MONO-D-GLUCURONATE

Common Name

English

Metesind glucuronate [WHO-DD]

Common Name

English

AG331

Code

English

METESIND GLUCURONATE [USAN]

Common Name

English

D-GLUCURONIC ACID, COMPD. WITH 4-((4-(((2-AMINOBENZ(CD)INDOL-6-YL)METHYLAMINO)METHYL)PHENYL)SULFONYL)MORPHOLINE (1:1)

Common Name

English

MORPHOLINE, 4-((4-(((2-AMINOBENZ(CD)INDOL-6-YL)METHYLAMINO)METHYL)PHENYL)SULFONYL)-, MONO-D-GLUCURONATE

Common Name

English

Code System Code Type Description

CAS

157182-23-5