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Details

Stereochemistry ABSOLUTE
Molecular Formula C69H85ClN16O13
Molecular Weight 1381.966
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-ACETYL-3,4-DIDEHYDRO-L-PROLYL-4-CHLORO-D-PHENYLALANYL-D-TRYPTOPHYL-L-SERYL-L-TYROSYL-D-TRYPTOPHYL-L-LEUCYL-L-ARGINYL-L-PROLYLGLYCINAMIDE

SMILES

CC(C)C[C@H](NC(=O)[C@@H](CC1=CNC2=C1C=CC=C2)NC(=O)[C@H](CC3=CC=C(O)C=C3)NC(=O)[C@H](CO)NC(=O)[C@@H](CC4=CNC5=C4C=CC=C5)NC(=O)[C@@H](CC6=CC=C(Cl)C=C6)NC(=O)[C@@H]7C=CCN7C(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N8CCC[C@H]8C(=O)NCC(N)=O

InChI

InChIKey=RLANJWSCJJGOMB-FZANJEFGSA-N
InChI=1S/C69H85ClN16O13/c1-38(2)29-51(60(91)78-50(15-8-26-74-69(72)73)68(99)86-28-10-16-57(86)66(97)77-36-59(71)90)79-63(94)54(32-42-34-75-48-13-6-4-11-46(42)48)81-61(92)52(31-41-20-24-45(89)25-21-41)80-65(96)56(37-87)84-64(95)55(33-43-35-76-49-14-7-5-12-47(43)49)82-62(93)53(30-40-18-22-44(70)23-19-40)83-67(98)58-17-9-27-85(58)39(3)88/h4-7,9,11-14,17-25,34-35,38,50-58,75-76,87,89H,8,10,15-16,26-33,36-37H2,1-3H3,(H2,71,90)(H,77,97)(H,78,91)(H,79,94)(H,80,96)(H,81,92)(H,82,93)(H,83,98)(H,84,95)(H4,72,73,74)/t50-,51-,52-,53+,54+,55+,56-,57-,58-/m0/s1

HIDE SMILES / InChI

Molecular Formula C69H85ClN16O13
Molecular Weight 1381.966
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:31:56 GMT 2023
Edited
by admin
on Sat Dec 16 08:31:56 GMT 2023
Record UNII
Q34868D5WX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-ACETYL-3,4-DIDEHYDRO-L-PROLYL-4-CHLORO-D-PHENYLALANYL-D-TRYPTOPHYL-L-SERYL-L-TYROSYL-D-TRYPTOPHYL-L-LEUCYL-L-ARGINYL-L-PROLYLGLYCINAMIDE
Systematic Name English
GLYCINAMIDE, 1-ACETYL-3,4-DIDEHYDRO-L-PROLYL-4-CHLORO-D-PHENYLALANYL-D-TRYPTOPHYL-L-SERYL-L-TYROSYL-D-TRYPTOPHYL-L-LEUCYL-L-ARGINYL-L-PROLYL-
Systematic Name English
LUTEINIZING HORMONE-RELEASING FACTOR (PIG), 1-(1-ACETYL-3,4-DIDEHYDRO-L-PROLINE)-2-(4-CHLORO-D-PHENYLALANINE)-3-D-TRYPTOPHAN-6-D-TRYPTOPHAN-
Common Name English
Code System Code Type Description
CAS
80152-22-3
Created by admin on Sat Dec 16 08:31:56 GMT 2023 , Edited by admin on Sat Dec 16 08:31:56 GMT 2023
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FDA UNII
Q34868D5WX
Created by admin on Sat Dec 16 08:31:56 GMT 2023 , Edited by admin on Sat Dec 16 08:31:56 GMT 2023
PRIMARY
EPA CompTox
DTXSID60230104
Created by admin on Sat Dec 16 08:31:56 GMT 2023 , Edited by admin on Sat Dec 16 08:31:56 GMT 2023
PRIMARY
PUBCHEM
25078132
Created by admin on Sat Dec 16 08:31:56 GMT 2023 , Edited by admin on Sat Dec 16 08:31:56 GMT 2023
PRIMARY