AURANTIOL

Details

Stereochemistry	RACEMIC
Molecular Formula	C18H27NO3
Molecular Weight	305.4119
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC(=O)C1=CC=CC=C1\N=C\CC(C)CCCC(C)(C)O

InChI

InChIKey=BFBPISPWJZMWJN-CPNJWEJPSA-N

InChI=1S/C18H27NO3/c1-14(8-7-12-18(2,3)21)11-13-19-16-10-6-5-9-15(16)17(20)22-4/h5-6,9-10,13-14,21H,7-8,11-12H2,1-4H3/b19-13+

HIDE SMILES / InChI

Molecular Formula	C18H27NO3
Molecular Weight	305.4119
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	1
Optical Activity	( + / - )

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:16:44 GMT 2025` Edited by `admin` on `Mon Mar 31 22:16:44 GMT 2025`
Record UNII	495739WRQE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AURANTIOL

Common Name

English

NSC-78483

Preferred Name

English

AURANTIOL, (±)-

Common Name

English

AURANTION

Common Name

English

ANTHRANILIC ACID, N-(7-HYDROXY-3,7-DIMETHYLOCTYLIDENE)-, METHYL ESTER

Systematic Name

English

HYDROXYCITRONELLYLIDENE METHYL ANTHRANILATE

Systematic Name

English

AURANTINE

Common Name

English

BENZOIC ACID, 2-((7-HYDROXY-3,7-DIMETHYLOCTYLIDENE)AMINO)-, METHYL ESTER

Systematic Name

English

AURANTIUM

Common Name

English

HYDROXYCITRONELLAL METHYL ANTHRANILATE

Systematic Name

English

BENZOIC ACID, 2-((E)-(7-HYDROXY-3,7-DIMETHYLOCTYLIDENE)AMINO)-, METHYL ESTER

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID60859152