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Details

Stereochemistry ABSOLUTE
Molecular Formula C64H97N19O20
Molecular Weight 1452.5703
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IMP-288

SMILES

NC(=O)[C@@H](CCCCNC(=O)CNC(=O)CCC(=O)NCCC1=CN=CN1)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@@H](CCCCNC(=O)CNC(=O)CCC(=O)NCCC2=CN=CN2)NC(=O)[C@@H](CC3=CC=C(O)C=C3)NC(=O)CN4CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC4

InChI

InChIKey=AUULGUVUMUKNPY-OGBYROOVSA-N
InChI=1S/C64H97N19O20/c65-61(100)46(5-1-3-19-68-54(89)34-72-52(87)14-12-50(85)70-21-17-43-32-66-40-74-43)77-63(102)48(11-16-57(92)93)79-62(101)47(6-2-4-20-69-55(90)35-73-53(88)15-13-51(86)71-22-18-44-33-67-41-75-44)78-64(103)49(31-42-7-9-45(84)10-8-42)76-56(91)36-80-23-25-81(37-58(94)95)27-29-83(39-60(98)99)30-28-82(26-24-80)38-59(96)97/h7-10,32-33,40-41,46-49,84H,1-6,11-31,34-39H2,(H2,65,100)(H,66,74)(H,67,75)(H,68,89)(H,69,90)(H,70,85)(H,71,86)(H,72,87)(H,73,88)(H,76,91)(H,77,102)(H,78,103)(H,79,101)(H,92,93)(H,94,95)(H,96,97)(H,98,99)/t46-,47-,48-,49-/m1/s1

HIDE SMILES / InChI

Molecular Formula C64H97N19O20
Molecular Weight 1452.5703
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 5
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:28:47 GMT 2023
Edited
by admin
on Sat Dec 16 10:28:47 GMT 2023
Record UNII
ECC868Y9YT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IMP-288
Code English
IMT-288
Code English
(4R)-5-(((1R)-1-CARBAMOYL-5-((2-((4-(2-(1H-IMIDAZOL-5-YL)ETHYLAMINO)-4-OXO-BUTANOYL)AMINO)ACETYL)AMINO)PENTYL)AMINO)-4-(((2R)-2-(((2R)-3-(4-HYDROXYPHENYL)-2-((2-(4,7,10-TRIS(CARBOXYMETHYL)-1,4,7,10-TETRAZACYCLODODEC-1-YL)ACETYL)AMINO)PROPANOYL)AMINO)-6-(
Systematic Name English
D-LYSINAMIDE, N-((4,7,10-TRIS(CARBOXYMETHYL)-1,4,7,10-TETRAAZACYCLODODEC-1-YL)ACETYL)-D-TYROSYL-N6-(N-(4-((2-(1H-IMIDAZOL-4-YL)ETHYL)AMINO)-1,4-DIOXOBUTYL)GLYCYL)-D-LYSYL-D-.ALPHA.-GLUTAMYL-N6-(N-(4-((2-(1H-IMIDAZOL-4-YL)ETHYL)AMINO)-1,4-DIOXOBUTYL)GLYCY
Systematic Name English
Code System Code Type Description
CAS
637771-94-9
Created by admin on Sat Dec 16 10:28:47 GMT 2023 , Edited by admin on Sat Dec 16 10:28:47 GMT 2023
PRIMARY
PUBCHEM
42628821
Created by admin on Sat Dec 16 10:28:47 GMT 2023 , Edited by admin on Sat Dec 16 10:28:47 GMT 2023
PRIMARY
FDA UNII
ECC868Y9YT
Created by admin on Sat Dec 16 10:28:47 GMT 2023 , Edited by admin on Sat Dec 16 10:28:47 GMT 2023
PRIMARY
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