DECURSINOL ANGELATE

Details

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

SHOW SMILES / InChI

Structure Search

SMILES

C\C=C(\C)C(=O)O[C@H]1CC2=CC3=C(OC(=O)C=C3)C=C2OC1(C)C

InChI

InChIKey=AGABNGOXUSXQDD-XKGFZTIGSA-N

InChI=1S/C19H20O5/c1-5-11(2)18(21)23-16-9-13-8-12-6-7-17(20)22-14(12)10-15(13)24-19(16,3)4/h5-8,10,16H,9H2,1-4H3/b11-5-/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	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:20:16 GMT 2023` Edited by `admin` on `Sat Dec 16 12:20:16 GMT 2023`
Record UNII	LXU5241LCL
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DECURSINOL ANGELATE

Common Name

English

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

Systematic Name

English

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

Systematic Name

English

ACUTILOBIN

Systematic Name

English

Code System Code Type Description

CAS

130848-06-5

Created by admin on Sat Dec 16 12:20:16 GMT 2023 , Edited by admin on Sat Dec 16 12:20:16 GMT 2023

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FDA UNII

LXU5241LCL

Created by admin on Sat Dec 16 12:20:16 GMT 2023 , Edited by admin on Sat Dec 16 12:20:16 GMT 2023

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EPA CompTox

DTXSID401315533

Created by admin on Sat Dec 16 12:20:16 GMT 2023 , Edited by admin on Sat Dec 16 12:20:16 GMT 2023

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PUBCHEM

776123

Created by admin on Sat Dec 16 12:20:16 GMT 2023 , Edited by admin on Sat Dec 16 12:20:16 GMT 2023

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