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Details

Stereochemistry ABSOLUTE
Molecular Formula C59H109N6O19P
Molecular Weight 1237.4993
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MIFAMURTIDE ACID

SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(O)(=O)OCCNC(=O)[C@H](C)NC(=O)CC[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](C)O[C@@H]([C@H](O)[C@H](O)CO)[C@@H](NC(C)=O)C=O)C(N)=O)OC(=O)CCCCCCCCCCCCCCC

InChI

InChIKey=ZVLWUMPAHCEZAW-KRNLDFAISA-N
InChI=1S/C59H109N6O19P/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-52(71)80-41-47(84-53(72)34-32-30-28-26-24-22-20-18-16-14-12-10-8-2)42-82-85(78,79)81-38-37-61-57(75)43(3)62-51(70)36-35-48(56(60)74)65-58(76)44(4)63-59(77)45(5)83-55(54(73)50(69)40-67)49(39-66)64-46(6)68/h39,43-45,47-50,54-55,67,69,73H,7-38,40-42H2,1-6H3,(H2,60,74)(H,61,75)(H,62,70)(H,63,77)(H,64,68)(H,65,76)(H,78,79)/t43-,44-,45+,47+,48+,49-,50+,54+,55+/m0/s1

HIDE SMILES / InChI

Molecular Formula C59H109N6O19P
Molecular Weight 1237.4993
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:20:54 UTC 2023
Edited
by admin
on Fri Dec 15 17:20:54 UTC 2023
Record UNII
EQD2NNX741
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MIFAMURTIDE ACID
Common Name English
MIFAMURTIDE FREE ACID ANHYDROUS
Common Name English
MIFAMURTIDE [MI]
Common Name English
L-ALANINAMIDE, N-(N-ACETYLMURAMOYL)-L-ALANYL-D-.ALPHA.-GLUTAMINYL-N-((7R)-4-HYDROXY-4-OXIDO-10-OXO-7-((1-OXOHEXADECYL)OXY)-3,5,9-TRIOXA-4-PHOSPHAPENTACOS-1-YL)-
Common Name English
Mifamurtide [WHO-DD]
Common Name English
mifamurtide [INN]
Common Name English
CGP-19835
Code English
(2R)-3-(((((4R,5R,7R,10S,13R,18S)-13-CARBAMOYL-4-FORMYL-7,10,18-TRIMETHYL-2,8,11,16,19-PENTAOXO-5-((1R,2R)-1,2,3-TRIHYDROXYPROPYL)-6-OXA-3,9,12,17,20-PENTAAZADOCOSAN-22-YL)OXY)(HYDROXY)PHOSPHORYL)OXY)PROPANE-1,2-DIYL DIPALMITATE
Systematic Name English
Classification Tree Code System Code
WHO-ATC L03AX15
Created by admin on Fri Dec 15 17:20:54 UTC 2023 , Edited by admin on Fri Dec 15 17:20:54 UTC 2023
Code System Code Type Description
PUBCHEM
76957626
Created by admin on Fri Dec 15 17:20:54 UTC 2023 , Edited by admin on Fri Dec 15 17:20:54 UTC 2023
PRIMARY
SMS_ID
100000091871
Created by admin on Fri Dec 15 17:20:54 UTC 2023 , Edited by admin on Fri Dec 15 17:20:54 UTC 2023
PRIMARY
INN
8744
Created by admin on Fri Dec 15 17:20:54 UTC 2023 , Edited by admin on Fri Dec 15 17:20:54 UTC 2023
PRIMARY
CAS
83461-56-7
Created by admin on Fri Dec 15 17:20:54 UTC 2023 , Edited by admin on Fri Dec 15 17:20:54 UTC 2023
PRIMARY
EVMPD
SUB25179
Created by admin on Fri Dec 15 17:20:54 UTC 2023 , Edited by admin on Fri Dec 15 17:20:54 UTC 2023
PRIMARY
FDA UNII
EQD2NNX741
Created by admin on Fri Dec 15 17:20:54 UTC 2023 , Edited by admin on Fri Dec 15 17:20:54 UTC 2023
PRIMARY
NCI_THESAURUS
C170174
Created by admin on Fri Dec 15 17:20:54 UTC 2023 , Edited by admin on Fri Dec 15 17:20:54 UTC 2023
PRIMARY
EPA CompTox
DTXSID601028849
Created by admin on Fri Dec 15 17:20:54 UTC 2023 , Edited by admin on Fri Dec 15 17:20:54 UTC 2023
PRIMARY
MERCK INDEX
m7535
Created by admin on Fri Dec 15 17:20:54 UTC 2023 , Edited by admin on Fri Dec 15 17:20:54 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
SALT/SOLVATE -> PARENT
TARGET->LIGAND
Related Record Type Details
ACTIVE MOIETY