Basic Searches
Searches without any special characters (listed below) will return items that contain the exact value(s) entered in the search field. This means that searching for "ASPIRIN CALCIUM" won't return any items that have "ASPIRIN GLYCINE CALCIUM" because the search term doesn't match exactly.
Boolean Operators
OR - searches with terms separated by " OR " will return items that contain any of the terms in the search.
Example: "ASPIRIN" OR "CALCIUM" will return items that have strings like "ASPIRIN GLYCINE" and "GLYCINE CALCIUM" because they contain at least one of the terms in the search.

AND - searches with terms separated by " AND " will return items that contain all the terms in the search.
Example: "ASPIRIN" AND "CALCIUM" won't return items that have strings "ASPIRIN GLYCINE" and "GLYCINE CALCIUM" because neither contain both terms, but it will return "ASPIRIN GLYCINE CALCIUM" because it contains both search terms.
version 2.5.1.2
Substance Class Chemical
Record UNII
O19V2N6W9T
Record Status Validated (UNII)
Record Version
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Details

Stereochemistry ABSOLUTE
Molecular Formula C49H76N6O11
Molecular Weight 925.1613
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0
Created by admin on Fri Jul 10 21:39:54 EDT 2020
Edited by admin on Fri Jul 10 21:39:54 EDT 2020
Structure of MAFODOTIN

Systematic Names:

  • None recorded
  • {{name}}

SMILES

[H][C@]1(CCCN1C(=O)C[C@@H](OC)[C@H]([C@@H](C)CC)N(C)C(=O)[C@@H](NC(=O)[C@H](C(C)C)N(C)C(=O)CCCCCN2C(=O)C=CC2=O)C(C)C)[C@H](OC)[C@@H](C)C(=O)N[C@@H](CC3=CC=CC=C3)C(O)=O

InChI

ORFNVPGICPYLJV-YTVPMEHESA-N
InChI=1S/C49H76N6O11/c1-12-32(6)44(37(65-10)29-41(59)54-27-19-22-36(54)45(66-11)33(7)46(60)50-35(49(63)64)28-34-20-15-13-16-21-34)53(9)48(62)42(30(2)3)51-47(61)43(31(4)5)52(8)38(56)23-17-14-18-26-55-39(57)24-25-40(55)58/h13,15-16,20-21,24-25,30-33,35-37,42-45H,12,14,17-19,22-23,26-29H2,1-11H3,(H,50,60)(H,51,61)(H,63,64)/t32-,33+,35-,36-,37+,42-,43-,44-,45+/m0/s1
Name Type Language Details References
MAFODOTIN
Domain Jurisdiction Naming Organization
drug  
USAN  
USAN  
Official Name
English  
N-((2R,3R)-3-((2S)-1-((3R,4S,5S)-4-((N-(6-(2,5-DIOXO-2,5-DIHYDRO-1H-PYRROL-1- YL)HEXANOYL)-N-METHYL-L-VALYL-L-VALYL(METHYLAMINO)-3-METHOXY-5- METHYLHEPTANOYL)PYRROLIDIN-2-YL)-3-METHOXY-2-METHYLPROPANOYL)-L-PHENYLALANINE
Common Name
English  
MC-MMAF
Code
English  
SGD-1269
Code
English  
MCMMAF
Code
English  
MAFODOTIN [USAN]
Common Name
English  
MCMMA-F
Code
English  
L-PHENYLALANINE, N-(6-(2,5-DIHYDRO-2,5-DIOXO-1H-PYRROL-1-YL)-1-OXOHEXYL)-N-METHYL-L-VALYL-L-VALYL-(3R,4S,5S)-3-METHOXY-5-METHYL-4-(METHYLAMINO)HEPTANOYL-(.ALPHA.R,.BETA.R,2S)-.BETA.-METHOXY-.ALPHA.-METHYL-2-PYRROLIDINEPROPANOYL-
Common Name
English  
Code System Code Type Description References
CAS
863971-19-1
Created by admin on Fri Jul 10 21:39:54 EDT 2020 , Edited by admin on Fri Jul 10 21:39:54 EDT 2020
PRIMARY
PUBCHEM
56949327
Created by admin on Fri Jul 10 21:39:54 EDT 2020 , Edited by admin on Fri Jul 10 21:39:54 EDT 2020
PRIMARY
ChEMBL
CHEMBL2107813
Created by admin on Fri Jul 10 21:39:54 EDT 2020 , Edited by admin on Fri Jul 10 21:39:54 EDT 2020
PRIMARY
EPA CompTox
863971-19-1
Created by admin on Fri Jul 10 21:39:54 EDT 2020 , Edited by admin on Fri Jul 10 21:39:54 EDT 2020
PRIMARY
Related Record Type Details References
CONJUGATE->CONJUGATE COMPONENT
none
none
Mediator Substance Details
none
Created by admin on Fri Jul 10 21:39:54 EDT 2020 , Edited by admin on Fri Jul 10 21:39:54 EDT 2020
CONJUGATE->CONJUGATE COMPONENT
none
none
Mediator Substance Details
none
Created by admin on Fri Jul 10 21:39:54 EDT 2020 , Edited by admin on Fri Jul 10 21:39:54 EDT 2020
CONJUGATE->CONJUGATE COMPONENT
none
none
Mediator Substance Details
none
Created by admin on Fri Jul 10 21:39:54 EDT 2020 , Edited by admin on Fri Jul 10 21:39:54 EDT 2020
CONJUGATE->CONJUGATE COMPONENT
none
none
Mediator Substance Details
none
Created by admin on Fri Jul 10 21:39:54 EDT 2020 , Edited by admin on Fri Jul 10 21:39:54 EDT 2020
Created Fri Jul 10 21:39:54 EDT 2020
Created By admin
Last Edited Fri Jul 10 21:39:54 EDT 2020
Last Edited By admin
Index Source Text / Citation Source Type Tags Date Accessed File
1 http://www.ama-assn.org/resources/doc/usan/mafodotin.pdf SRS NOMEN
2 usan coun 2012 SRS NOMEN PUBLIC_DOMAIN_RELEASE AUTO_SELECTED
3 dump-public-2020-07-07.gsrs BATCH_IMPORT Fri Jul 10 21:39:49 EDT 2020
4 SRS import [O19V2N6W9T] SRS NOMEN Fri Apr 28 15:00:26 EDT 2017
5 SRS CODE IMPORT SRS NOMEN Fri Apr 28 15:00:26 EDT 2017
6 STN STN (SCIFINDER)
7 stn SRS NOMEN
8 USAN COUN 2012 USANCOUN NOMEN PUBLIC_DOMAIN_RELEASE
9 MAFODOTIN [USAN] SRS_LOCATOR
10 WEBSITE WEBSITE NOMEN PUBLIC_DOMAIN_RELEASE
11 USP DICTIONARY SRS NOMEN

Molecular Formula C49H76N6O11
Molecular Weight 925.1613
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED