Anomalin, (±)-

Details

Stereochemistry	RACEMIC
Molecular Formula	C24H26O7
Molecular Weight	426.459
Optical Activity	( + / - )
Defined Stereocenters	2 / 2
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C\C=C(\C)C(=O)O[C@@H]1[C@H](OC(=O)C(\C)=C/C)C(C)(C)OC2=CC=C3C=CC(=O)OC3=C12

InChI

InChIKey=PNTWXEIQXBRCPS-UWOGZXHISA-N

InChI=1S/C24H26O7/c1-7-13(3)22(26)29-20-18-16(11-9-15-10-12-17(25)28-19(15)18)31-24(5,6)21(20)30-23(27)14(4)8-2/h7-12,20-21H,1-6H3/b13-7-,14-8-/t20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C24H26O7
Molecular Weight	426.459
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	2
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 20:34:30 GMT 2025` Edited by `admin` on `Wed Apr 02 20:34:30 GMT 2025`
Record UNII	L7296ACU3S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Anomalin, (±)-

Common Name

English

(±)-Praeruptorin B

Preferred Name

English

2-Butenoic acid, 2-methyl-, 9,10-dihydro-8,8-dimethyl-2-oxo-2H,8H-benzo[1,2-b:3,4-b?]dipyran-9,10-diyl ester, [9?(Z),10?(Z)]-(±)-

Systematic Name

English

2-Butenoic acid, 2-methyl-, (9R,10R)-9,10-dihydro-8,8-dimethyl-2-oxo-2H,8H-benzo[1,2-b:3,4-b?]dipyran-9,10-diyl ester, (2Z,2?Z)-rel-

Systematic Name

English

Code System Code Type Description

FDA UNII

L7296ACU3S

Created by admin on Wed Apr 02 20:34:30 GMT 2025 , Edited by admin on Wed Apr 02 20:34:30 GMT 2025

PRIMARY

CAS

73069-26-8

Created by admin on Wed Apr 02 20:34:30 GMT 2025 , Edited by admin on Wed Apr 02 20:34:30 GMT 2025

PRIMARY

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