CINCHONAIN IA

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H20O9
Molecular Weight	452.4102
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O[C@@H]1CC2=C(O)C=C3OC(=O)C[C@H](C4=CC=C(O)C(O)=C4)C3=C2O[C@@H]1C5=CC=C(O)C(O)=C5

InChI

InChIKey=LKCOZWLUAKSRQM-UMAWSMADSA-N

InChI=1S/C24H20O9/c25-14-3-1-10(5-17(14)28)12-8-21(31)32-20-9-16(27)13-7-19(30)23(33-24(13)22(12)20)11-2-4-15(26)18(29)6-11/h1-6,9,12,19,23,25-30H,7-8H2/t12-,19-,23-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H20O9
Molecular Weight	452.4102
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:42:16 GMT 2025` Edited by `admin` on `Mon Mar 31 22:42:16 GMT 2025`
Record UNII	XAW49PG8E7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(-)-CINCHONAIN IA

Preferred Name

English

CINCHONAIN IA

Common Name

English

(2R,3R,10R)-2,10-BIS(3,4-DIHYDROXYPHENYL)-3,4,9,10-TETRAHYDRO-3,5-DIHYDROXY-2H,8H-BENZO(1,2-B:3,4-B')DIPYRAN-8-ONE

Systematic Name

English

2H,8H-BENZO(1,2-B:3,4-B')DIPYRAN-8-ONE, 2,10-BIS(3,4-DIHYDROXYPHENYL)-3,4,9,10-TETRAHYDRO-3,5-DIHYDROXY-, (2R-(2.ALPHA.,3.ALPHA.,10.ALPHA.))-

Systematic Name

English

Code System Code Type Description

FDA UNII

XAW49PG8E7

Created by admin on Mon Mar 31 22:42:16 GMT 2025 , Edited by admin on Mon Mar 31 22:42:16 GMT 2025

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CAS

85081-24-9

Created by admin on Mon Mar 31 22:42:16 GMT 2025 , Edited by admin on Mon Mar 31 22:42:16 GMT 2025

PRIMARY

PUBCHEM

442675

Created by admin on Mon Mar 31 22:42:16 GMT 2025 , Edited by admin on Mon Mar 31 22:42:16 GMT 2025

PRIMARY

EPA CompTox

DTXSID40331901

Created by admin on Mon Mar 31 22:42:16 GMT 2025 , Edited by admin on Mon Mar 31 22:42:16 GMT 2025

PRIMARY

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