LOCUSTOL

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H12O2
Molecular Weight	152.1904
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCC1=CC(O)=C(OC)C=C1

InChI

InChIKey=CAWZFQGJUGEKFU-UHFFFAOYSA-N

InChI=1S/C9H12O2/c1-3-7-4-5-9(11-2)8(10)6-7/h4-6,10H,3H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C9H12O2
Molecular Weight	152.1904
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Iridoid and aromatic glycosides from Scrophularia ningpoensis Hemsl. and their inhibition of [Ca2+](i) increase induced by KCl.	2008-09	18816525

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:02:08 GMT 2025` Edited by `admin` on `Mon Mar 31 19:02:08 GMT 2025`
Record UNII	G8V5WHB17K
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

LOCUSTOL

Common Name

English

GUAIACOL, 5-ETHYL-

Preferred Name

English

5-ETHYLGUAIACOL

Common Name

English

PHENOL, 5-ETHYL-2-METHOXY-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID50182163

Created by admin on Mon Mar 31 19:02:08 GMT 2025 , Edited by admin on Mon Mar 31 19:02:08 GMT 2025

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PUBCHEM

3083782

Created by admin on Mon Mar 31 19:02:08 GMT 2025 , Edited by admin on Mon Mar 31 19:02:08 GMT 2025

PRIMARY

FDA UNII

G8V5WHB17K

Created by admin on Mon Mar 31 19:02:08 GMT 2025 , Edited by admin on Mon Mar 31 19:02:08 GMT 2025

PRIMARY

CAS

2785-88-8

Created by admin on Mon Mar 31 19:02:08 GMT 2025 , Edited by admin on Mon Mar 31 19:02:08 GMT 2025

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