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Details

Stereochemistry ABSOLUTE
Molecular Formula C80H102ClN23O12.C2H4O2
Molecular Weight 1673.3208
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PRAZARELIX ACETATE

SMILES

CC(O)=O.CC(C)C[C@H](NC(=O)[C@@H](CC1=CC=C(NC2=NN=C(N)N2)C=C1)NC(=O)[C@H](CC3=CC=C(NC4=NN=C(N)N4)C=C3)NC(=O)[C@H](CO)NC(=O)[C@@H](CC5=CC=CN=C5)NC(=O)[C@@H](CC6=CC=C(Cl)C=C6)NC(=O)[C@@H](CC7=CC=C8C=CC=CC8=C7)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N9CCC[C@H]9C(=O)N[C@H](C)C(N)=O

InChI

InChIKey=UYXOLEHMGDKCEI-OKBORMFFSA-N
InChI=1S/C80H102ClN23O12.C2H4O2/c1-44(2)35-59(68(108)91-58(16-9-10-33-86-45(3)4)76(116)104-34-12-17-66(104)75(115)87-46(5)67(82)107)92-70(110)62(38-49-21-28-56(29-22-49)89-79-98-77(83)100-102-79)94-72(112)63(39-50-23-30-57(31-24-50)90-80-99-78(84)101-103-80)96-74(114)65(43-105)97-73(113)64(41-52-13-11-32-85-42-52)95-71(111)61(37-48-19-26-55(81)27-20-48)93-69(109)60(88-47(6)106)40-51-18-25-53-14-7-8-15-54(53)36-51;1-2(3)4/h7-8,11,13-15,18-32,36,42,44-46,58-66,86,105H,9-10,12,16-17,33-35,37-41,43H2,1-6H3,(H2,82,107)(H,87,115)(H,88,106)(H,91,108)(H,92,110)(H,93,109)(H,94,112)(H,95,111)(H,96,114)(H,97,113)(H4,83,89,98,100,102)(H4,84,90,99,101,103);1H3,(H,3,4)/t46-,58+,59+,60-,61-,62-,63+,64-,65+,66+;/m1./s1

HIDE SMILES / InChI

Molecular Formula C80H102ClN23O12
Molecular Weight 1613.2688
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula C2H4O2
Molecular Weight 60.052
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Prazarelix is gonadorelin (GnRH) antagonist. It is primarily used in assisted reproduction to control ovulation. The drug works by blocking the action of GnRH upon the pituitary, thus rapidly suppressing the production and action of luteinizing hormone (LH) and follicle-stimulating hormone (FSH).

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 18:03:39 GMT 2025
Edited
by admin
on Mon Mar 31 18:03:39 GMT 2025
Record UNII
3N0Y1LR8V4
Record Status FAILED
Record Version
  • Download
Name Type Language
RWJ-47428
Preferred Name English
PRAZARELIX ACETATE
USAN  
USAN  
Official Name English
AZALINE B
Common Name English
RWJ47428
Code English
PRAZARELIX ACETATE [USAN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C2092
Created by admin on Mon Mar 31 18:03:39 GMT 2025 , Edited by admin on Mon Mar 31 18:03:39 GMT 2025
Code System Code Type Description
PUBCHEM
70697644
Created by admin on Mon Mar 31 18:03:39 GMT 2025 , Edited by admin on Mon Mar 31 18:03:39 GMT 2025
PRIMARY
FDA UNII
3N0Y1LR8V4
Created by admin on Mon Mar 31 18:03:39 GMT 2025 , Edited by admin on Mon Mar 31 18:03:39 GMT 2025
PRIMARY
EPA CompTox
DTXSID20172192
Created by admin on Mon Mar 31 18:03:39 GMT 2025 , Edited by admin on Mon Mar 31 18:03:39 GMT 2025
PRIMARY
CAS
225931-76-0
Created by admin on Mon Mar 31 18:03:39 GMT 2025 , Edited by admin on Mon Mar 31 18:03:39 GMT 2025
ALTERNATIVE
CAS
188405-78-9
Created by admin on Mon Mar 31 18:03:39 GMT 2025 , Edited by admin on Mon Mar 31 18:03:39 GMT 2025
PRIMARY
CAS
134485-10-2
Created by admin on Mon Mar 31 18:03:39 GMT 2025 , Edited by admin on Mon Mar 31 18:03:39 GMT 2025
NON-SPECIFIC STOICHIOMETRY
SMS_ID
300000055013
Created by admin on Mon Mar 31 18:03:39 GMT 2025 , Edited by admin on Mon Mar 31 18:03:39 GMT 2025
PRIMARY
ChEMBL
CHEMBL409018
Created by admin on Mon Mar 31 18:03:39 GMT 2025 , Edited by admin on Mon Mar 31 18:03:39 GMT 2025
PRIMARY
NCI_THESAURUS
C97709
Created by admin on Mon Mar 31 18:03:39 GMT 2025 , Edited by admin on Mon Mar 31 18:03:39 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY