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Details

Stereochemistry ABSOLUTE
Molecular Formula C49H74N12O10
Molecular Weight 991.1882
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Buserelin-(3-9)-peptide,

SMILES

CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](COC(C)(C)C)NC(=O)[C@H](CC2=CC=C(O)C=C2)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC3=CNC4=CC=CC=C34

InChI

InChIKey=BAVFTTUHVOJIOZ-RKWGXVJDSA-N
InChI=1S/C49H74N12O10/c1-7-53-46(69)40-15-11-21-61(40)47(70)35(14-10-20-54-48(51)52)56-42(65)36(22-28(2)3)57-45(68)39(27-71-49(4,5)6)60-43(66)37(23-29-16-18-31(63)19-17-29)58-44(67)38(26-62)59-41(64)33(50)24-30-25-55-34-13-9-8-12-32(30)34/h8-9,12-13,16-19,25,28,33,35-40,55,62-63H,7,10-11,14-15,20-24,26-27,50H2,1-6H3,(H,53,69)(H,56,65)(H,57,68)(H,58,67)(H,59,64)(H,60,66)(H4,51,52,54)/t33-,35-,36-,37-,38-,39+,40-/m0/s1

HIDE SMILES / InChI

Molecular Formula C49H74N12O10
Molecular Weight 991.1882
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:05:49 GMT 2025
Edited
by admin
on Wed Apr 02 17:05:49 GMT 2025
Record UNII
FKP6N46VYK
Record Status FAILED
Record Version
  • Download
Name Type Language
BUSERELIN IMPURITY C [EP IMPURITY]
Preferred Name English
Buserelin-(3-9)-peptide,
Common Name English
L-Prolinamide, L-tryptophyl-L-seryl-L-tyrosyl-O-(1,1-dimethylethyl)-D-seryl-L-leucyl-L-arginyl-N-ethyl-
Systematic Name English
Code System Code Type Description
PUBCHEM
87789622
Created by admin on Wed Apr 02 17:05:49 GMT 2025 , Edited by admin on Wed Apr 02 17:05:49 GMT 2025
PRIMARY
FDA UNII
FKP6N46VYK
Created by admin on Wed Apr 02 17:05:49 GMT 2025 , Edited by admin on Wed Apr 02 17:05:49 GMT 2025
PRIMARY
CAS
70280-55-6
Created by admin on Wed Apr 02 17:05:49 GMT 2025 , Edited by admin on Wed Apr 02 17:05:49 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY