FRENOLICIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H18O7
Molecular Weight	346.3313
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCC[C@H]1O[C@H](CC(O)=O)C[C@]23O[C@]12C(=O)C4=C(O)C=CC=C4C3=O

InChI

InChIKey=RJPAAOHQLUUTRQ-KSVPUCKHSA-N

InChI=1S/C18H18O7/c1-2-4-12-18-16(23)14-10(5-3-6-11(14)19)15(22)17(18,25-18)8-9(24-12)7-13(20)21/h3,5-6,9,12,19H,2,4,7-8H2,1H3,(H,20,21)/t9-,12-,17-,18+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C18H18O7
Molecular Weight	346.3313
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:44:18 GMT 2025` Edited by `admin` on `Mon Mar 31 22:44:18 GMT 2025`
Record UNII	H1POH9E7JP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

FRENOLICIN [MI]

Preferred Name

English

FRENOLICIN

Common Name

English

(1R,3S,4AS,10AR)-3,4,5,10-TETRAHYDRO-9-HYDROXY-5,10-DIOXO-1-PROPYL-4A,10A-EPOXY-1H-NAPHTHO(2,3-C)PYRAN-3-ACETIC ACID

Systematic Name

English

FRENOLICINE

Common Name

English

4A,10A-EPOXY-1H-NAPHTHO(2,3-C)PYRAN-3-ACETIC ACID, 3,4,5,10-TETRAHYDRO-9-HYDROXY-5,10-DIOXO-1-PROPYL-, (1R,3S,4AS,10AR)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID20433578