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Details

Stereochemistry ABSOLUTE
Molecular Formula C45H62N10O6
Molecular Weight 839.0372
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PMX-205

SMILES

[H][C@@]12CCCN1C(=O)[C@H](CCCNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC3=CNC4=CC=CC=C34)NC(=O)[C@@H](CC5CCCCC5)NC2=O)NC(=O)CCC6=CC=CC=C6

InChI

InChIKey=VATFHFJULBPYLM-ILOBPARPSA-N
InChI=1S/C45H62N10O6/c46-45(47)49-24-9-18-34-40(57)48-23-10-19-35(51-39(56)22-21-29-12-3-1-4-13-29)44(61)55-25-11-20-38(55)43(60)54-36(26-30-14-5-2-6-15-30)41(58)53-37(42(59)52-34)27-31-28-50-33-17-8-7-16-32(31)33/h1,3-4,7-8,12-13,16-17,28,30,34-38,50H,2,5-6,9-11,14-15,18-27H2,(H,48,57)(H,51,56)(H,52,59)(H,53,58)(H,54,60)(H4,46,47,49)/t34-,35-,36+,37-,38-/m0/s1

HIDE SMILES / InChI

Molecular Formula C45H62N10O6
Molecular Weight 839.0372
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 19:05:06 UTC 2023
Edited
by admin
on Thu Jul 06 19:05:06 UTC 2023
Record UNII
DC25O3L7KZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PMX-205
Code English
PMX205
Code English
CYCLIC HEXAPEPTIDE COMPLEMENT C5A ANTAGONIST
Common Name English
LP-16
Code English
HYDROCINNAMATE-(ORN-PRO-DCHA-TRP-ARG)
Common Name English
Code System Code Type Description
PUBCHEM
6918845
Created by admin on Thu Jul 06 19:05:06 UTC 2023 , Edited by admin on Thu Jul 06 19:05:06 UTC 2023
PRIMARY
FDA UNII
DC25O3L7KZ
Created by admin on Thu Jul 06 19:05:06 UTC 2023 , Edited by admin on Thu Jul 06 19:05:06 UTC 2023
PRIMARY
CAS
514814-49-4
Created by admin on Thu Jul 06 19:05:06 UTC 2023 , Edited by admin on Thu Jul 06 19:05:06 UTC 2023
PRIMARY
CHEBI
144869
Created by admin on Thu Jul 06 19:05:06 UTC 2023 , Edited by admin on Thu Jul 06 19:05:06 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
ANTAGONIST
IC50
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY