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Details

Stereochemistry ACHIRAL
Molecular Formula 8C9H10N4O4.7C4H10N2
Molecular Weight 2508.55
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACEFYLLINE PIPERAZINE

SMILES

C1CNCCN1.C2CNCCN2.C3CNCCN3.C4CNCCN4.C5CNCCN5.C6CNCCN6.C7CNCCN7.CN8C9=C(N(CC(O)=O)C=N9)C(=O)N(C)C8=O.CN%10C%11=C(N(CC(O)=O)C=N%11)C(=O)N(C)C%10=O.CN%12C%13=C(N(CC(O)=O)C=N%13)C(=O)N(C)C%12=O.CN%14C%15=C(N(CC(O)=O)C=N%15)C(=O)N(C)C%14=O.CN%16C%17=C(N(CC(O)=O)C=N%17)C(=O)N(C)C%16=O.CN%18C%19=C(N(CC(O)=O)C=N%19)C(=O)N(C)C%18=O.CN%20C%21=C(N(CC(O)=O)C=N%21)C(=O)N(C)C%20=O.CN%22C%23=C(N(CC(O)=O)C=N%23)C(=O)N(C)C%22=O

InChI

InChIKey=IUKJNIOSXCPLLP-UHFFFAOYSA-N
InChI=1S/8C9H10N4O4.7C4H10N2/c8*1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15;7*1-2-6-4-3-5-1/h8*4H,3H2,1-2H3,(H,14,15);7*5-6H,1-4H2

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 C4H10N2
Molecular Weight 86.1356
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 14:57:36 UTC 2023
Edited
by admin
on Fri Dec 15 14:57:36 UTC 2023
Record UNII
12I91IOS6Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACEFYLLINE PIPERAZINE
INN   MART.   WHO-DD  
INN  
Official Name English
75-78% ACEFYLLINE AND 22-25% PIPERAZINE
Common Name English
ACEFYLLINE COMPD WITH PIPERAZINE [MI]
Common Name English
ACEPIFYLLINE
Common Name English
DYNAPHYLLINE
Brand Name English
ACEFYLLINE PIPERAZINE [MART.]
Common Name English
ACEFYLLINE COMPD WITH PIPERAZINE
MI  
Common Name English
ETAFILLINA
Brand Name English
Acefylline piperazine [WHO-DD]
Common Name English
PIPERAZINE 7-THEOPHYLLINEACETATE
Systematic Name English
EPICOPHYLLINE
Brand Name English
acefylline piperazine [INN]
Common Name English
PIPERAZINE THEOPHYLLINE ETHANOATE
Systematic Name English
ETAPHYLLINE
Brand Name English
Classification Tree Code System Code
NCI_THESAURUS C319
Created by admin on Fri Dec 15 14:57:36 UTC 2023 , Edited by admin on Fri Dec 15 14:57:36 UTC 2023
WHO-VATC QR03DA09
Created by admin on Fri Dec 15 14:57:36 UTC 2023 , Edited by admin on Fri Dec 15 14:57:36 UTC 2023
WHO-ATC R03DA09
Created by admin on Fri Dec 15 14:57:36 UTC 2023 , Edited by admin on Fri Dec 15 14:57:36 UTC 2023
Code System Code Type Description
CAS
18833-13-1
Created by admin on Fri Dec 15 14:57:36 UTC 2023 , Edited by admin on Fri Dec 15 14:57:36 UTC 2023
PRIMARY
EPA CompTox
DTXSID10939812
Created by admin on Fri Dec 15 14:57:36 UTC 2023 , Edited by admin on Fri Dec 15 14:57:36 UTC 2023
PRIMARY
INN
1583
Created by admin on Fri Dec 15 14:57:36 UTC 2023 , Edited by admin on Fri Dec 15 14:57:36 UTC 2023
PRIMARY
ChEMBL
CHEMBL70246
Created by admin on Fri Dec 15 14:57:36 UTC 2023 , Edited by admin on Fri Dec 15 14:57:36 UTC 2023
PRIMARY
MERCK INDEX
m1295
Created by admin on Fri Dec 15 14:57:36 UTC 2023 , Edited by admin on Fri Dec 15 14:57:36 UTC 2023
PRIMARY Merck Index
FDA UNII
12I91IOS6Z
Created by admin on Fri Dec 15 14:57:36 UTC 2023 , Edited by admin on Fri Dec 15 14:57:36 UTC 2023
PRIMARY
NCI_THESAURUS
C74218
Created by admin on Fri Dec 15 14:57:36 UTC 2023 , Edited by admin on Fri Dec 15 14:57:36 UTC 2023
PRIMARY
PUBCHEM
76959346
Created by admin on Fri Dec 15 14:57:36 UTC 2023 , Edited by admin on Fri Dec 15 14:57:36 UTC 2023
PRIMARY
DRUG BANK
DBSALT002522
Created by admin on Fri Dec 15 14:57:36 UTC 2023 , Edited by admin on Fri Dec 15 14:57:36 UTC 2023
PRIMARY
SMS_ID
100000078534
Created by admin on Fri Dec 15 14:57:36 UTC 2023 , Edited by admin on Fri Dec 15 14:57:36 UTC 2023
PRIMARY
ECHA (EC/EINECS)
242-614-3
Created by admin on Fri Dec 15 14:57:36 UTC 2023 , Edited by admin on Fri Dec 15 14:57:36 UTC 2023
PRIMARY
EVMPD
SUB12706MIG
Created by admin on Fri Dec 15 14:57:36 UTC 2023 , Edited by admin on Fri Dec 15 14:57:36 UTC 2023
PRIMARY
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ACTIVE MOIETY