NEPITRIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H22O12
Molecular Weight	478.4029
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=C(O)C2=C(OC(=CC2=O)C3=CC=C(O)C(O)=C3)C=C1O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O

InChI

InChIKey=DMXHXBGUNHLMQO-IWLDQSELSA-N

InChI=1S/C22H22O12/c1-31-21-14(33-22-20(30)19(29)17(27)15(7-23)34-22)6-13-16(18(21)28)11(26)5-12(32-13)8-2-3-9(24)10(25)4-8/h2-6,15,17,19-20,22-25,27-30H,7H2,1H3/t15-,17-,19+,20-,22-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H22O12
Molecular Weight	478.4029
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 08:39:48 GMT 2023` Edited by `admin` on `Sat Dec 16 08:39:48 GMT 2023`
Record UNII	S9ZMJ20NUO
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NEPITRIN

Common Name

English

6-METHOXYLUTEOLIN 7-GLUCOSIDE

Common Name

English

NEPETRIN

Common Name

English

2-(3,4-DIHYDROXYPHENYL)-5-HYDROXY-6-METHOXY-4-OXO-4H-CHROMEN-7-YL .BETA.-D-GLUCOPYRANOSIDE

Systematic Name

English

J16.151I

Code

English

NEPETIN 7-O-.BETA.-D-GLUCOSIDE

Common Name

English

NEPETIN 7-O-.BETA.-D-GLUCOPYRANOSIDE

Common Name

English

NEPETIN 7-O-GLUCOSIDE

Common Name

English

3',4',5-TRIHYDROXY-6-METHOXY-7-(GLUCOSYLOXY)FLAVONE

Systematic Name

English

EUPAFOLIN 7-O-.BETA.-GLUCOSIDE

Common Name

English

EUPAFOLIN 7-O-.BETA.-D-GLUCOPYRANOSIDE

Common Name

English

6-METHOXYLUTEOLIN 7-O-GLUCOSIDE

Common Name

English

5-HYDROXY-6-METHOXY-2-(3,4-DIHYDROXYPHENYL)-7-(.BETA.-D-GLUCOPYRANOSYLOXY)-4H-1-BENZOPYRAN-4-ONE

Systematic Name

English

FLAVONE, 3',4',5,7-TETRAHYDROXY-6-METHOXY-, 7-.BETA.-D-GLUCOPYRANOSIDE

Systematic Name

English

2-(3,4-DIHYDROXYPHENYL)-5-HYDROXY-6-METHOXY-7-(((2S,3R,4S,5S,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL)OXY)CHROMEN-4-ONE

Systematic Name

English

EUPAFOLIN 7-.BETA.-GLUCOSIDE

Common Name

English

4H-1-BENZOPYRAN-4-ONE, 2-(3,4-DIHYDROXYPHENYL)-7-(.BETA.-D-GLUCOPYRANOSYLOXY)-5-HYDROXY-6-METHOXY-

Systematic Name

English

2-(3,4-DIHYDROXYPHENYL)-5-HYDROXY-6-METHOXY-7-(((2S,3R,4S,5S,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL)OXY)-4H-CHROMEN-4-ONE

Systematic Name

English

4H-1-BENZOPYRAN-4-ONE, 2-(3,4-DIHYDROXYPHENYL)-7-(BETA-D-GLUCOPYRANOSYLOXY)-5-HYDROXY-6-METHOXY-

Systematic Name

English

Code System Code Type Description

CAS

27923-79-1