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Details

Stereochemistry RACEMIC
Molecular Formula C46H58ClN5O8.2C4H4O4
Molecular Weight 1076.579
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of PROGLUMETACIN MALEATE

SMILES

OC(=O)\C=C/C(O)=O.OC(=O)\C=C/C(O)=O.CCCN(CCC)C(=O)C(CCC(=O)OCCCN1CCN(CCOC(=O)CC2=C(C)N(C(=O)C3=CC=C(Cl)C=C3)C4=C2C=C(OC)C=C4)CC1)NC(=O)C5=CC=CC=C5

InChI

InChIKey=MKFWBVKQDGNXDW-SPIKMXEPSA-N
InChI=1S/C46H58ClN5O8.2C4H4O4/c1-5-21-51(22-6-2)46(57)40(48-44(55)34-11-8-7-9-12-34)18-20-42(53)59-29-10-23-49-24-26-50(27-25-49)28-30-60-43(54)32-38-33(3)52(41-19-17-37(58-4)31-39(38)41)45(56)35-13-15-36(47)16-14-35;2*5-3(6)1-2-4(7)8/h7-9,11-17,19,31,40H,5-6,10,18,20-30,32H2,1-4H3,(H,48,55);2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-

HIDE SMILES / InChI

Molecular Formula C4H4O4
Molecular Weight 116.0722
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Molecular Formula C46H58ClN5O8
Molecular Weight 844.434
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 19:02:45 UTC 2023
Edited
by admin
on Fri Dec 15 19:02:45 UTC 2023
Record UNII
F2PUN24B8C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PROGLUMETACIN MALEATE
JAN   MART.   WHO-DD  
Common Name English
PROGLUMETACIN DIMALEATE
MI  
Common Name English
PROXIL
Brand Name English
1H-INDOLE-3-ACETIC ACID, 1-(4-CHLOROBENZOYL)-5-METHOXY-2-METHYL-, 2-(4-(3-((4-(BENZOYLAMINO)-5-(DIPROPYLAMINO)-1,5-DIOXOPENTYL)OXY)PROPYL)-1-PIPERAZINYL)ETHYL ESTER, (±)-, (Z)-2-BUTENEDIOATE (1:2)
Systematic Name English
PROGLUMETACIN MALEATE [MART.]
Common Name English
PROGLUMETACIN MALEATE [JAN]
Common Name English
Proglumetacin maleate [WHO-DD]
Common Name English
PROTACINE
Brand Name English
MIRIDACIN
Brand Name English
1H-INDOLE-3-ACETIC ACID, 1-(4-CHLOROBENZOYL)-5-METHOXY-2-METHYL-, 2-(4-(3-((4-(BENZOYLAMINO)-5-(DIPROPYLAMINO)-1,5-DIOXOPENTYL)OXY)PROPYL)-1-PIPERAZINYL)ETHYL ESTER, (2Z)-2-BUTENEDIOATE (1:2)
Systematic Name English
PROTAXON
Brand Name English
PROGLUMETACIN DIMALEATE [MI]
Common Name English
BRUXEL
Brand Name English
CR-604
Code English
1H-INDOLE-3-ACETIC ACID, 1-(4-CHLOROBENZOYL)-5-METHOXY-2-METHYL-, 2-(4-(3-((4-(BENZOYLAMINO)-5-(DIPROPYLAMINO)-1,5-DIOXOPENTYL)OXY)PROPYL)-1-PIPERAZINYL)ETHYL ESTER, (Z)-2-BUTENEDIOATE (1:2)
Common Name English
AFLOXAN
Brand Name English
Code System Code Type Description
MERCK INDEX
m9160
Created by admin on Fri Dec 15 19:02:45 UTC 2023 , Edited by admin on Fri Dec 15 19:02:45 UTC 2023
PRIMARY Merck Index
EVMPD
SUB22421
Created by admin on Fri Dec 15 19:02:45 UTC 2023 , Edited by admin on Fri Dec 15 19:02:45 UTC 2023
PRIMARY
CAS
104060-59-5
Created by admin on Fri Dec 15 19:02:45 UTC 2023 , Edited by admin on Fri Dec 15 19:02:45 UTC 2023
NON-SPECIFIC STOICHIOMETRY
FDA UNII
F2PUN24B8C
Created by admin on Fri Dec 15 19:02:45 UTC 2023 , Edited by admin on Fri Dec 15 19:02:45 UTC 2023
PRIMARY
CHEBI
32057
Created by admin on Fri Dec 15 19:02:45 UTC 2023 , Edited by admin on Fri Dec 15 19:02:45 UTC 2023
PRIMARY
CAS
59209-40-4
Created by admin on Fri Dec 15 19:02:45 UTC 2023 , Edited by admin on Fri Dec 15 19:02:45 UTC 2023
PRIMARY
ChEMBL
CHEMBL2105825
Created by admin on Fri Dec 15 19:02:45 UTC 2023 , Edited by admin on Fri Dec 15 19:02:45 UTC 2023
PRIMARY
EVMPD
SUB04061MIG
Created by admin on Fri Dec 15 19:02:45 UTC 2023 , Edited by admin on Fri Dec 15 19:02:45 UTC 2023
PRIMARY
MESH
C019541
Created by admin on Fri Dec 15 19:02:45 UTC 2023 , Edited by admin on Fri Dec 15 19:02:45 UTC 2023
PRIMARY
SMS_ID
100000086044
Created by admin on Fri Dec 15 19:02:45 UTC 2023 , Edited by admin on Fri Dec 15 19:02:45 UTC 2023
PRIMARY
PUBCHEM
5282193
Created by admin on Fri Dec 15 19:02:45 UTC 2023 , Edited by admin on Fri Dec 15 19:02:45 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY