Isonigerone

Details

Stereochemistry	ACHIRAL
Molecular Formula	C32H26O10
Molecular Weight	570.5428
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC2=C(C(OC)=C1)C3=C(C(=O)C=C(C)O3)C(O)=C2C4=C5C=C(OC)C=C(OC)C5=C(O)C6=C4OC(C)=CC6=O

InChI

InChIKey=CQWZRVPFGYDTKI-UHFFFAOYSA-N

InChI=1S/C32H26O10/c1-13-7-20(34)28-30(36)25(18-10-16(38-4)12-22(40-6)24(18)31(28)41-13)26-17-9-15(37-3)11-21(39-5)23(17)29(35)27-19(33)8-14(2)42-32(26)27/h7-12,35-36H,1-6H3

HIDE SMILES / InChI

Molecular Formula	C32H26O10
Molecular Weight	570.5428
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:07:42 GMT 2025` Edited by `admin` on `Mon Mar 31 21:07:42 GMT 2025`
Record UNII	3E7PXL6WKH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISONIGERONE-

Preferred Name

English

Isonigerone

Common Name

English

5-HYDROXY-6-(5-HYDROXY-6,8-DIMETHOXY-2-METHYL-4-OXO-BENZO(G)CHROMEN-10-YL)-8,10-DIMETHOXY-2-METHYL-BENZO(H)CHROMEN-4-ONE

Systematic Name

English

Iso-nigerone

Common Name

English

(6S)-5-Hydroxy-6-(5-hydroxy-6,8-dimethoxy-2-methyl-4-oxo-4H-naphtho[2,3-b]pyran-10-yl)-8,10-dimethoxy-2-methyl-4H-naphtho[1,2-b]pyran-4-one

Systematic Name

English

4H-Naphtho[1,2-b]pyran-4-one, 5-hydroxy-6-(5-hydroxy-6,8-dimethoxy-2-methyl-4-oxo-4H-naphtho[2,3-b]pyran-10-yl)-8,10-dimethoxy-2-methyl-, (6S)-

Systematic Name

English

Code System Code Type Description

FDA UNII

3E7PXL6WKH

Created by admin on Mon Mar 31 21:07:42 GMT 2025 , Edited by admin on Mon Mar 31 21:07:42 GMT 2025

PRIMARY

CAS

76045-72-2

Created by admin on Mon Mar 31 21:07:42 GMT 2025 , Edited by admin on Mon Mar 31 21:07:42 GMT 2025

PRIMARY

PUBCHEM

101278413

Created by admin on Mon Mar 31 21:07:42 GMT 2025 , Edited by admin on Mon Mar 31 21:07:42 GMT 2025

PRIMARY