(2S,3S,4S,5R,6S)-6-(2,3-DICHLORO-4-PIPERAZIN-1-YL-PHENOXY)-3,4,5-TRIHYDROXY-TETRAHYDROPYRAN-2-CARBOXYLIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H20Cl2N2O7
Molecular Weight	423.245
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (2S,3S,4S,5R,6S)-6-(2,3-DICHLORO-4-PIPERAZIN-1-YL-PHENOXY)-3,4,5-TRIHYDROXY-TETRAHYDROPYRAN-2-CARBOXYLIC ACID

Structure Search

SMILES

O[C@@H]1[C@@H](O)[C@H](OC2=C(Cl)C(Cl)=C(C=C2)N3CCNCC3)O[C@@H]([C@H]1O)C(O)=O

InChI

InChIKey=GHZUDPNROWVKAZ-JHZZJYKESA-N

InChI=1S/C16H20Cl2N2O7/c17-9-7(20-5-3-19-4-6-20)1-2-8(10(9)18)26-16-13(23)11(21)12(22)14(27-16)15(24)25/h1-2,11-14,16,19,21-23H,3-6H2,(H,24,25)/t11-,12-,13+,14-,16+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C16H20Cl2N2O7
Molecular Weight	423.245
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:12:27 GMT 2023` Edited by `admin` on `Sat Dec 16 15:12:27 GMT 2023`
Record UNII	HCV8Y9CQ9E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(2S,3S,4S,5R,6S)-6-(2,3-DICHLORO-4-PIPERAZIN-1-YL-PHENOXY)-3,4,5-TRIHYDROXY-TETRAHYDROPYRAN-2-CARBOXYLIC ACID

Systematic Name

English

GLUCURONIDE OF DM-1431

Common Name

English

Code System Code Type Description

PUBCHEM

146019455

Created by admin on Sat Dec 16 15:12:28 GMT 2023 , Edited by admin on Sat Dec 16 15:12:28 GMT 2023

PRIMARY

FDA UNII

HCV8Y9CQ9E

Created by admin on Sat Dec 16 15:12:28 GMT 2023 , Edited by admin on Sat Dec 16 15:12:28 GMT 2023

PRIMARY

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