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

Details

Stereochemistry ABSOLUTE
Molecular Formula C73H89ClN14O13
Molecular Weight 1406.027
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LHRH, (N-AC-PRO1,D-P-CLPHE2, D-NAL(2)3,6)-

SMILES

CC(C)C[C@H](NC(=O)[C@@H](CC1=CC2=CC=CC=C2C=C1)NC(=O)[C@H](CC3=CC=C(O)C=C3)NC(=O)[C@H](CO)NC(=O)[C@@H](CC4=CC5=CC=CC=C5C=C4)NC(=O)[C@@H](CC6=CC=C(Cl)C=C6)NC(=O)[C@@H]7CCCN7C(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N8CCC[C@H]8C(=O)NCC(N)=O

InChI

InChIKey=VLAHCTGYEJMKKF-CRJOYQNVSA-N
InChI=1S/C73H89ClN14O13/c1-42(2)33-55(64(93)80-54(15-8-30-78-73(76)77)72(101)88-32-10-16-61(88)70(99)79-40-63(75)92)81-67(96)58(38-46-18-24-48-11-4-6-13-50(48)34-46)82-65(94)56(37-45-22-28-53(91)29-23-45)84-69(98)60(41-89)86-68(97)59(39-47-19-25-49-12-5-7-14-51(49)35-47)83-66(95)57(36-44-20-26-52(74)27-21-44)85-71(100)62-17-9-31-87(62)43(3)90/h4-7,11-14,18-29,34-35,42,54-62,89,91H,8-10,15-17,30-33,36-41H2,1-3H3,(H2,75,92)(H,79,99)(H,80,93)(H,81,96)(H,82,94)(H,83,95)(H,84,98)(H,85,100)(H,86,97)(H4,76,77,78)/t54-,55-,56-,57+,58+,59+,60-,61-,62-/m0/s1

HIDE SMILES / InChI

Molecular Formula C73H89ClN14O13
Molecular Weight 1406.027
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 08:22:59 GMT 2023
Edited
by admin
on Sat Dec 16 08:22:59 GMT 2023
Record UNII
V1YNO60FPF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LHRH, (N-AC-PRO1,D-P-CLPHE2, D-NAL(2)3,6)-
Common Name English
LUTEINIZING HORMONE-RELEASING FACTOR (PIG), 1-(1-ACETYL-L-PROLINE)-(4-CHLORO-D-PHENYLALANINE)-3-(3-(2-NAPHTHALENYL)-D-ALANINE)-6-(3-(2-NAPHTHALENYL)-D-ALANINE)-
Systematic Name English
(N-AC-PRO1,D-P-CLPHE2, D-NAL(2)3,6)-LH-RH
Common Name English
Code System Code Type Description
PUBCHEM
25081013
Created by admin on Sat Dec 16 08:22:59 GMT 2023 , Edited by admin on Sat Dec 16 08:22:59 GMT 2023
PRIMARY
FDA UNII
V1YNO60FPF
Created by admin on Sat Dec 16 08:22:59 GMT 2023 , Edited by admin on Sat Dec 16 08:22:59 GMT 2023
PRIMARY
CAS
82778-57-2
Created by admin on Sat Dec 16 08:22:59 GMT 2023 , Edited by admin on Sat Dec 16 08:22:59 GMT 2023
PRIMARY
EPA CompTox
DTXSID00231993
Created by admin on Sat Dec 16 08:22:59 GMT 2023 , Edited by admin on Sat Dec 16 08:22:59 GMT 2023
PRIMARY