U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C59H84N18O14
Molecular Weight 1269.4128
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Oxo-L-prolyl-L-histidyl-L-tryptophyl-D-seryl-L-tyrosyl-O-(1,1-dimethylethyl)-D-seryl-L-leucyl-L-arginyl-L-proline 2-(aminocarbonyl)hydrazide

SMILES

CC(C)C[C@H](NC(=O)[C@@H](COC(C)(C)C)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H](CO)NC(=O)[C@H](CC2=CNC3=C2C=CC=C3)NC(=O)[C@H](CC4=CNC=N4)NC(=O)[C@@H]5CCC(=O)N5)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N6CCC[C@H]6C(=O)NNC(N)=O

InChI

InChIKey=BLCLNMBMMGCOAS-AGWWGSAASA-N
InChI=1S/C59H84N18O14/c1-31(2)22-40(49(82)68-39(12-8-20-64-57(60)61)56(89)77-21-9-13-46(77)55(88)75-76-58(62)90)69-54(87)45(29-91-59(3,4)5)74-50(83)41(23-32-14-16-35(79)17-15-32)70-53(86)44(28-78)73-51(84)42(24-33-26-65-37-11-7-6-10-36(33)37)71-52(85)43(25-34-27-63-30-66-34)72-48(81)38-18-19-47(80)67-38/h6-7,10-11,14-17,26-27,30-31,38-46,65,78-79H,8-9,12-13,18-25,28-29H2,1-5H3,(H,63,66)(H,67,80)(H,68,82)(H,69,87)(H,70,86)(H,71,85)(H,72,81)(H,73,84)(H,74,83)(H,75,88)(H4,60,61,64)(H3,62,76,90)/t38-,39-,40-,41-,42-,43-,44+,45+,46-/m0/s1

HIDE SMILES / InChI

Molecular Formula C59H84N18O14
Molecular Weight 1269.4128
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 Wed Apr 02 17:56:04 GMT 2025
Edited
by admin
on Wed Apr 02 17:56:04 GMT 2025
Record UNII
JG3LU3EM7R
Record Status FAILED
Record Version
  • Download
Name Type Language
GOSERELIN IMPURITY A [EP IMPURITY]
Preferred Name English
5-Oxo-L-prolyl-L-histidyl-L-tryptophyl-D-seryl-L-tyrosyl-O-(1,1-dimethylethyl)-D-seryl-L-leucyl-L-arginyl-L-proline 2-(aminocarbonyl)hydrazide
Systematic Name English
1-9-Luteinizing hormone-releasing factor (swine), 4-D-serine-6-[O-(1,1-dimethylethyl)-D-serine]-, 2-(aminocarbonyl)hydrazide
Systematic Name English
L-Proline, 5-oxo-L-prolyl-L-histidyl-L-tryptophyl-D-seryl-L-tyrosyl-O-(1,1-dimethylethyl)-D-seryl-L-leucyl-L-arginyl-, 2-(aminocarbonyl)hydrazide
Systematic Name English
Code System Code Type Description
CAS
1926163-39-4
Created by admin on Wed Apr 02 17:56:04 GMT 2025 , Edited by admin on Wed Apr 02 17:56:04 GMT 2025
PRIMARY
PUBCHEM
131698121
Created by admin on Wed Apr 02 17:56:04 GMT 2025 , Edited by admin on Wed Apr 02 17:56:04 GMT 2025
PRIMARY
FDA UNII
JG3LU3EM7R
Created by admin on Wed Apr 02 17:56:04 GMT 2025 , Edited by admin on Wed Apr 02 17:56:04 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY