PHEBALOSIN

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NCATS

Details

Stereochemistry	UNKNOWN
Molecular Formula	C15H14O4
Molecular Weight	258.2693
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PHEBALOSIN

Structure Search

SMILES

COC1=C([C@H]2O[C@@H]2C(C)=C)C3=C(C=CC(=O)O3)C=C1

InChI

InChIKey=YTDNHMHONBWCBV-UKRRQHHQSA-N

InChI=1S/C15H14O4/c1-8(2)13-15(19-13)12-10(17-3)6-4-9-5-7-11(16)18-14(9)12/h4-7,13,15H,1H2,2-3H3/t13-,15-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C15H14O4
Molecular Weight	258.2693
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:05:43 GMT 2025` Edited by `admin` on `Mon Mar 31 22:05:43 GMT 2025`
Record UNII	57637245VY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ALOSIN

Preferred Name

English

PHEBALOSIN

Common Name

English

COUMARIN, 8-(1,2-EPOXY-3-METHYL-3-BUTENYL)-7-METHOXY-, 8-TRANS-

Systematic Name

English

2H-1-BENZOPYRAN-2-ONE, 7-METHOXY-8-(3-(1-METHYLETHENYL)OXIRANYL)-, TRANS-

Systematic Name

English

2H-1-BENZOPYRAN-2-ONE, 7-METHOXY-8-((2R,3R)-3-(1-METHYLETHENYL)OXIRANYL)-, REL-

Systematic Name

English

Code System Code Type Description

PUBCHEM

188300

Created by admin on Mon Mar 31 22:05:43 GMT 2025 , Edited by admin on Mon Mar 31 22:05:43 GMT 2025

PRIMARY

CAS

675845-86-0

Created by admin on Mon Mar 31 22:05:43 GMT 2025 , Edited by admin on Mon Mar 31 22:05:43 GMT 2025

ALTERNATIVE

CAS

6545-99-9

Created by admin on Mon Mar 31 22:05:43 GMT 2025 , Edited by admin on Mon Mar 31 22:05:43 GMT 2025

PRIMARY

FDA UNII

57637245VY

Created by admin on Mon Mar 31 22:05:43 GMT 2025 , Edited by admin on Mon Mar 31 22:05:43 GMT 2025

PRIMARY

CAS

26116-48-3

Created by admin on Mon Mar 31 22:05:43 GMT 2025 , Edited by admin on Mon Mar 31 22:05:43 GMT 2025

SUPERSEDED

EPA CompTox

DTXSID20215775

Created by admin on Mon Mar 31 22:05:43 GMT 2025 , Edited by admin on Mon Mar 31 22:05:43 GMT 2025

PRIMARY