2-(?-D-Glucopyranosyloxy)-7-hydroxy-2H-1,4-benzoxazin-3(4H)-one

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C14H17NO9
Molecular Weight	343.2861
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-(?-D-Glucopyranosyloxy)-7-hydroxy-2H-1,4-benzoxazin-3(4H)-one

Structure Search

SMILES

OC[C@@H]1O[C@H](O[C@H]2OC3=C(NC2=O)C=CC(O)=C3)[C@@H](O)[C@H](O)[C@H]1O

InChI

InChIKey=VUFDXOACUHDTLI-XGEMBROFSA-N

InChI=1S/C14H17NO9/c16-4-8-9(18)10(19)11(20)13(23-8)24-14-12(21)15-6-2-1-5(17)3-7(6)22-14/h1-3,8-11,13-14,16-20H,4H2,(H,15,21)/t8-,9-,10+,11-,13+,14+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C14H17NO9
Molecular Weight	343.2861
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 16:57:53 GMT 2025` Edited by `admin` on `Wed Apr 02 16:57:53 GMT 2025`
Record UNII	4D3UTV959P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DHBOA-Glc

Preferred Name

English

2-(?-D-Glucopyranosyloxy)-7-hydroxy-2H-1,4-benzoxazin-3(4H)-one

Systematic Name

English

2H-1,4-Benzoxazin-3(4H)-one, 2-(?-D-glucopyranosyloxy)-7-hydroxy-

Systematic Name

English

Code System Code Type Description

PUBCHEM

133562203

Created by admin on Wed Apr 02 16:57:53 GMT 2025 , Edited by admin on Wed Apr 02 16:57:53 GMT 2025

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FDA UNII

4D3UTV959P

Created by admin on Wed Apr 02 16:57:53 GMT 2025 , Edited by admin on Wed Apr 02 16:57:53 GMT 2025

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EPA CompTox

DTXSID801173632

Created by admin on Wed Apr 02 16:57:53 GMT 2025 , Edited by admin on Wed Apr 02 16:57:53 GMT 2025

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CAS

28512-70-1

Created by admin on Wed Apr 02 16:57:53 GMT 2025 , Edited by admin on Wed Apr 02 16:57:53 GMT 2025

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