OLEOCANTHAL

Investigational

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C17H20O5
Molecular Weight	304.3377
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C\C=C(\C=O)[C@@H](CC=O)CC(=O)OCCC1=CC=C(O)C=C1

InChI

InChIKey=VPOVFCBNUOUZGG-VAKDEWRISA-N

InChI=1S/C17H20O5/c1-2-14(12-19)15(7-9-18)11-17(21)22-10-8-13-3-5-16(20)6-4-13/h2-6,9,12,15,20H,7-8,10-11H2,1H3/b14-2-/t15-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C17H20O5
Molecular Weight	304.3377
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

PubMed

Title	Date	PubMed

Substance Class	Chemical Created by `admin` on `Sat Dec 16 20:18:38 GMT 2023` Edited by `admin` on `Sat Dec 16 20:18:38 GMT 2023`
Record UNII	AC7QO6038O
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

OLEOCANTHAL

Official Name

English

2-(4-HYDROXYPHENYL)ETHYL (3S,4E)-4-FORMYL-3-(2-OXOETHYL)HEX-4-ENOATE

Systematic Name

English

OLEOCANTHAL, (-)-

Common Name

English

(3S,4E)-4-FORMYL-3-(2-OXOETHYL)-4-HEXENOIC ACID 2-(4-HYDROXYPHENYL)ETHYL ESTER

Systematic Name

English

DEACETOXY LIGSTROSIDE AGLYCON

Common Name

English

(-)-OLEOCANTHAL

Common Name

English

4-HEXENOIC ACID, 4-FORMYL-3-(2-OXOETHYL)-, 2-(4-HYDROXYPHENYL)ETHYL ESTER, (3S,4E)-

Systematic Name

English

OLEOCANTHAL [MI]

Common Name

English

OLEOCANTHAL [INCI]

Common Name

English

Code System Code Type Description

CAS

289030-99-5