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Details

Stereochemistry RACEMIC
Molecular Formula C13H21NO3
Molecular Weight 239.3107
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOETHARINE

SMILES

CC[C@@H](NC(C)C)[C@@H](O)C1=CC(O)=C(O)C=C1

InChI

InChIKey=HUYWAWARQUIQLE-MFKMUULPSA-N
InChI=1S/C13H21NO3/c1-4-10(14-8(2)3)13(17)9-5-6-11(15)12(16)7-9/h5-8,10,13-17H,4H2,1-3H3/t10-,13+/m1/s1

HIDE SMILES / InChI
Molecular Formula C13H21NO3
Molecular Weight 239.3107
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:31:31 UTC 2023
Edited
by admin
on Fri Dec 15 16:31:31 UTC 2023
Record UNII
YV0SN3276Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOETHARINE
MI   USAN   USP   VANDF  
USAN  
Official Name English
ISOETHARINE [USP IMPURITY]
Common Name English
ETYPRENALINE
Common Name English
ISOETHARINE [VANDF]
Common Name English
WIN-3046
Code English
Isoetarine [WHO-DD]
Common Name English
NEOISUPREL
Brand Name English
DILABRON
Brand Name English
isoetarine [INN]
Common Name English
1,2-BENZENEDIOL, 4-(1-HYDROXY-2-((1-METHYLETHYL)AMINO)BUTYL)-
Systematic Name English
ISOETARINE [MART.]
Common Name English
ISOETHARINE [MI]
Common Name English
WIN3406
Code English
3,4-Dihydroxy-α-[1-(isopropylamino)propyl]benzyl alcohol
Systematic Name English
ISOETHARINE [USAN]
Common Name English
(±)-ISOETHARINE
Common Name English
ISOETARINE
INN   MART.   WHO-DD  
INN  
Official Name English
Classification Tree Code System Code
WHO-ATC R03CC06
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
WHO-ATC R03AC07
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
WHO-VATC QR03AC07
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
WHO-VATC QR03CC06
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
NCI_THESAURUS C319
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
NCI_THESAURUS C48149
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
Code System Code Type Description
DRUG CENTRAL
1491
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY
LACTMED
Isoetharine
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY
ECHA (EC/EINECS)
208-472-1
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY
SMS_ID
100000082809
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY
IUPHAR
7205
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY
WIKIPEDIA
ISOETARINE
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY
CAS
530-08-5
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
NON-SPECIFIC STEREOCHEMISTRY
EPA CompTox
DTXSID9048560
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY
INN
1384
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY
MERCK INDEX
m6485
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY Merck Index
ChEMBL
CHEMBL1201213
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY
MESH
D007528
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY
FDA UNII
YV0SN3276Q
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY
DRUG BANK
DB00221
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY
RXCUI
6023
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY RxNorm
PUBCHEM
71466
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY
CAS
79490-84-9
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY
NCI_THESAURUS
C65974
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY
EVMPD
SUB08316MIG
Created by admin on Fri Dec 15 16:31:32 UTC 2023 , Edited by admin on Fri Dec 15 16:31:32 UTC 2023
PRIMARY
Related Record Type Details
Structure of ISOETHARINE HYDROCHLORIDE
SALT/SOLVATE -> PARENT
Structure of ISOETHARINE MESYLATE
SALT/SOLVATE -> PARENT
Related Record Type Details
Structure of ISOETHARINE
ACTIVE MOIETY
NIH
NCATS
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