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Details

Stereochemistry RACEMIC
Molecular Formula C9H10N4O4.C8H19NO
Molecular Weight 383.4427
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACEFYLLINE HEPTAMINOL

SMILES

CC(N)CCCC(C)(C)O.CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O

InChI

InChIKey=DWOMKMOQZYKZKX-UHFFFAOYSA-N
InChI=1S/C9H10N4O4.C8H19NO/c1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15;1-7(9)5-4-6-8(2,3)10/h4H,3H2,1-2H3,(H,14,15);7,10H,4-6,9H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C9H10N4O4
Molecular Weight 238.2001
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C8H19NO
Molecular Weight 145.2426
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:07:42 UTC 2023
Edited
by admin
on Fri Dec 15 18:07:42 UTC 2023
Record UNII
WL6JNI78OE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACEFYLLINE HEPTAMINOL
Common Name English
7H-PURINE-7-ACETIC ACID, 1,2,3,6-TETRAHYDRO-1,3-DIMETHYL-2,6-DIOXO-, COMPD. WITH 6-AMINO-2-METHYL-2-HEPTANOL (1:1)
Common Name English
HEPTAMINOL ACEFYLLINATE [MART.]
Common Name English
HEPTAMINOL ACEFYLLINE
WHO-DD  
Common Name English
HEPTAMINOL ACEFYLLINATE
MART.  
Common Name English
COROPHYLLINE
Common Name English
TETRAHYDRO-1,3-DIMETHYL-2,6-DIOXO-7H-PURINE-7-ACETIC ACID COMPD. WITH 6-AMINO-2-METHYLHEPTAN-2-OL (1:1)
Systematic Name English
CARIAMYL
Brand Name English
Heptaminol acefylline [WHO-DD]
Common Name English
Code System Code Type Description
RXCUI
236292
Created by admin on Fri Dec 15 18:07:42 UTC 2023 , Edited by admin on Fri Dec 15 18:07:42 UTC 2023
PRIMARY RxNorm
EPA CompTox
DTXSID20905720
Created by admin on Fri Dec 15 18:07:42 UTC 2023 , Edited by admin on Fri Dec 15 18:07:42 UTC 2023
PRIMARY
ECHA (EC/EINECS)
233-205-0
Created by admin on Fri Dec 15 18:07:42 UTC 2023 , Edited by admin on Fri Dec 15 18:07:42 UTC 2023
PRIMARY
EVMPD
SUB02487MIG
Created by admin on Fri Dec 15 18:07:42 UTC 2023 , Edited by admin on Fri Dec 15 18:07:42 UTC 2023
PRIMARY
CAS
10075-18-0
Created by admin on Fri Dec 15 18:07:42 UTC 2023 , Edited by admin on Fri Dec 15 18:07:42 UTC 2023
PRIMARY
FDA UNII
WL6JNI78OE
Created by admin on Fri Dec 15 18:07:42 UTC 2023 , Edited by admin on Fri Dec 15 18:07:42 UTC 2023
PRIMARY
SMS_ID
100000086698
Created by admin on Fri Dec 15 18:07:42 UTC 2023 , Edited by admin on Fri Dec 15 18:07:42 UTC 2023
PRIMARY
PUBCHEM
3084058
Created by admin on Fri Dec 15 18:07:42 UTC 2023 , Edited by admin on Fri Dec 15 18:07:42 UTC 2023
PRIMARY
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PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY