U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C9H6O2
Molecular Weight 146.1427
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of COUMARIN

SMILES

O=C1OC2=C(C=CC=C2)C=C1

InChI

InChIKey=ZYGHJZDHTFUPRJ-UHFFFAOYSA-N
InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H

HIDE SMILES / InChI

Approval Year

Unknown
86413
Name Type Language
COUMARIN
HSDB   INCI   MART.   MI   WHO-DD  
INCI  
Official Name English
COUMARIN (PROHIBITED) [FHFI]
Common Name English
COUMARIN (CONSTITUENT OF CINNAMOMUM CASSIA BARK) [DSC]
Common Name English
COUMARIN [IARC]
Common Name English
CIS-O-COUMARINIC ACID LACTONE
Common Name English
CUMARIN
Common Name English
Coumarin [WHO-DD]
Common Name English
COUMARIN [MI]
Common Name English
COUMARINIC ANHYDRIDE
Systematic Name English
COUMARINUM
HPUS  
Common Name English
NCI-C07103
Common Name English
COUMARIN (CONSTITUENT OF CINNAMOMUM VERUM BARK) [DSC]
Common Name English
COUMARIN [MART.]
Common Name English
COUMARIN [INCI]
Common Name English
COUMARINIC LACTONE
Common Name English
2-PROPENOIC ACID, 3-(2-HYDROXYPHENYL)-, .DELTA.-LACTONE
Common Name English
TONKA BEAN CAMPHOR
Common Name English
2H-1-BENZOPYRAN-2-ONE
Systematic Name English
2H-BENZO(B)PYRAN-2-ONE
Systematic Name English
NSC-8774
Code English
COUMARINUM [HPUS]
Common Name English
1,2-BENZOPYRONE
Common Name English
COUMARIN [HSDB]
Common Name English
O-HYDROXYCINNAMIC ACID LACTONE
Common Name English
Classification Tree Code System Code
CFR 21 CFR 189.130
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
NCI_THESAURUS C263
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
NCI_THESAURUS C54060
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
EPA PESTICIDE CODE 127301
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
FDA ORPHAN DRUG 84294
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
EC SCIENTIFIC COMMITTEE ON CONSUMER SAFETY OPINION SCCS/1459/11
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
Code System Code Type Description
NSC
8774
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
DRUG BANK
DB04665
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
CAS
91-64-5
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
MESH
C030123
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
PUBCHEM
323
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
HSDB
1623
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
DRUG CENTRAL
738
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
DAILYMED
A4VZ22K1WT
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
WIKIPEDIA
COUMARIN
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
RXCUI
2898
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY RxNorm
ECHA (EC/EINECS)
202-086-7
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
ChEMBL
CHEMBL6466
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
MERCK INDEX
m3820
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY Merck Index
FDA UNII
A4VZ22K1WT
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
NCI_THESAURUS
C397
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
SMS_ID
100000079833
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
EPA CompTox
DTXSID7020348
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
CHEBI
28794
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
EVMPD
SUB13479MIG
Created by admin on Fri Dec 15 15:17:40 UTC 2023 , Edited by admin on Fri Dec 15 15:17:40 UTC 2023
PRIMARY
ACTIVE MOIETY
Structure of COUMARIN
METABOLITE (PARENT)
Structure of UMBELLIFERONE
METABOLITE (PARENT)
Structure of COUMARIN 3,4 EPOXIDE
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966