PHYLLOSTINE

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C7H6O4
Molecular Weight	154.1201
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PHYLLOSTINE

Structure Search

SMILES

[H][C@]12O[C@@]1([H])C(=O)C(CO)=CC2=O

InChI

InChIKey=PLELZLHJHUZIGY-RQJHMYQMSA-N

InChI=1S/C7H6O4/c8-2-3-1-4(9)6-7(11-6)5(3)10/h1,6-8H,2H2/t6-,7+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C7H6O4
Molecular Weight	154.1201
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 `Fri Dec 15 18:08:28 GMT 2023` Edited by `admin` on `Fri Dec 15 18:08:28 GMT 2023`
Record UNII	B1K54WA3BP
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

PHYLLOSTINE

Common Name

English

7-OXABICYCLO(4.1.0)HEPT-3-ENE-2,5-DIONE, 3-(HYDROXYMETHYL)-, (1R,6S)-

Systematic Name

English

(-)-PHYLLOSTINE

Common Name

English

PHYLLOSTIN

Common Name

English

(1R,6S)-3-(HYDROXYMETHYL)-7-OXABICYCLO(4.1.0)HEPT-3-ENE-2,5-DIONE

Systematic Name

English

Code System Code Type Description

PUBCHEM

168678

Created by admin on Fri Dec 15 18:08:28 GMT 2023 , Edited by admin on Fri Dec 15 18:08:28 GMT 2023

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CHEBI

145110

Created by admin on Fri Dec 15 18:08:28 GMT 2023 , Edited by admin on Fri Dec 15 18:08:28 GMT 2023

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FDA UNII

B1K54WA3BP

Created by admin on Fri Dec 15 18:08:28 GMT 2023 , Edited by admin on Fri Dec 15 18:08:28 GMT 2023

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EPA CompTox

DTXSID60181723

Created by admin on Fri Dec 15 18:08:28 GMT 2023 , Edited by admin on Fri Dec 15 18:08:28 GMT 2023

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CAS

27270-89-9

Created by admin on Fri Dec 15 18:08:28 GMT 2023 , Edited by admin on Fri Dec 15 18:08:28 GMT 2023

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