DECURSIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H20O5
Molecular Weight	328.3591
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)=CC(=O)O[C@H]1CC2=C(OC1(C)C)C=C3OC(=O)C=CC3=C2

InChI

InChIKey=CUKSFECWKQBVED-INIZCTEOSA-N

InChI=1S/C19H20O5/c1-11(2)7-18(21)23-16-9-13-8-12-5-6-17(20)22-14(12)10-15(13)24-19(16,3)4/h5-8,10,16H,9H2,1-4H3/t16-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C19H20O5
Molecular Weight	328.3591
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 05:40:51 GMT 2023` Edited by `admin` on `Sat Dec 16 05:40:51 GMT 2023`
Record UNII	E95RTO3YQR
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DECURSIN

Official Name

English

CROTONIC ACID, 3-METHYL-, ESTER WITH 7,8-DIHYDRO-7-HYDROXY-8,8-DIMETHYL-2H,6H-BENZO(1,2-B:5,4-B')DIPYRAN-2-ONE, (+)-

Systematic Name

English

2-BUTENOIC ACID, 3-METHYL-, 7,8-DIHYDRO-8,8-DIMETHYL-2-OXO-2H,6H-BENZO(1,2-B:5,4-B')DIPYRAN-7-YL ESTER, (S)-

Systematic Name

English

DECURSIN [INCI]

Common Name

English

2-BUTENOIC ACID, 3-METHYL-, (7S)-7,8-DIHYDRO-8,8-DIMETHYL-2-OXO-2H,6H-PYRANO(3,2-G)-1-BENZOPYRAN-7-YL ESTER

Systematic Name

English

(+)-DECURSIN

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID90974706

Created by admin on Sat Dec 16 05:40:51 GMT 2023 , Edited by admin on Sat Dec 16 05:40:51 GMT 2023

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CAS

5928-25-6

Created by admin on Sat Dec 16 05:40:51 GMT 2023 , Edited by admin on Sat Dec 16 05:40:51 GMT 2023

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FDA UNII

E95RTO3YQR

Created by admin on Sat Dec 16 05:40:51 GMT 2023 , Edited by admin on Sat Dec 16 05:40:51 GMT 2023

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PUBCHEM

442126

Created by admin on Sat Dec 16 05:40:51 GMT 2023 , Edited by admin on Sat Dec 16 05:40:51 GMT 2023

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