HISTRELIN

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C66H86N18O12
Molecular Weight	1323.5024
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of HISTRELIN

Structure Search

SMILES

CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC2=CN(CC3=CC=CC=C3)C=N2)NC(=O)[C@H](CC4=CC=C(O)C=C4)NC(=O)[C@H](CO)NC(=O)[C@H](CC5=CNC6=C5C=CC=C6)NC(=O)[C@H](CC7=CNC=N7)NC(=O)[C@@H]8CCC(=O)N8

InChI

InChIKey=HHXHVIJIIXKSOE-QILQGKCVSA-N

InChI=1S/C66H86N18O12/c1-4-70-64(95)55-17-11-25-84(55)65(96)48(16-10-24-71-66(67)68)76-58(89)49(26-38(2)3)77-62(93)53(30-43-34-83(37-74-43)33-40-12-6-5-7-13-40)81-59(90)50(27-39-18-20-44(86)21-19-39)78-63(94)54(35-85)82-60(91)51(28-41-31-72-46-15-9-8-14-45(41)46)79-61(92)52(29-42-32-69-36-73-42)80-57(88)47-22-23-56(87)75-47/h5-9,12-15,18-21,31-32,34,36-38,47-55,72,85-86H,4,10-11,16-17,22-30,33,35H2,1-3H3,(H,69,73)(H,70,95)(H,75,87)(H,76,89)(H,77,93)(H,78,94)(H,79,92)(H,80,88)(H,81,90)(H,82,91)(H4,67,68,71)/t47-,48-,49-,50-,51-,52-,53+,54-,55-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C66H86N18O12
Molecular Weight	1323.5024
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	3
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:51:50 UTC 2023` Edited by `admin` on `Fri Dec 15 15:51:50 UTC 2023`
Record UNII	H50H3S3W74
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

HISTRELIN

Official Name

English

LUTEINIZING HORMONE-RELEASING FACTOR (PIG), 6-(1-(PHENYLMETHYL)-D-HISTIDINE)-9-(N-ETHYL-L-PROLINAMIDE)-10-DEGLYCINAMIDE-

Common Name

English

histrelin [INN]

Common Name

English

HISTRELIN [USAN]

Common Name

English

5-OXO-L-PROLYL-L-HISTIDYL-L-TRYPTOPHYL-L-SERYL-L-TYROSYL-NT-BENZYL-D-HISTIDYL-L-LEUCYL-L-ARGINYL-N-ETHYL-L-PROLINAMIDE

Common Name

English

HISTRELIN [MI]

Common Name

English

HISTRELIN [HSDB]

Common Name

English

ORF-17070

Code

English

Histrelin [WHO-DD]

Common Name

English

HISTRELIN [VANDF]

Common Name

English

ORF 17070RWJ 17070

Code

English

RWJ-17070

Code

English

HISTRELIN [MART.]

Common Name

English

Classification Tree Code System Code

NDF-RT

N0000175654

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

WHO-VATC

QL02AE05

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

FDA ORPHAN DRUG

212605

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

NCI_THESAURUS

C1910

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

FDA ORPHAN DRUG

28488

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

WHO-ATC

L02AE05

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

NDF-RT

N0000175655

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

WHO-ATC

H01CA03

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

Code System Code Type Description

DRUG BANK

DB06788

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

PRIMARY

DRUG CENTRAL

2975

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

PRIMARY

ChEMBL

CHEMBL1201255

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

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EPA CompTox

DTXSID50227543

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

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CAS

76712-82-8

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

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IUPHAR

3884

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

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MESH

C029256

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

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HSDB

7657

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

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USAN

W-105

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

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EVMPD

SUB08046MIG

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

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MERCK INDEX

m6030

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

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Merck Index

DAILYMED

H50H3S3W74

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

PRIMARY

PUBCHEM

25077993

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

PRIMARY

RXCUI

50975

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

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RxNorm

FDA UNII

H50H3S3W74

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

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NCI_THESAURUS

C74270

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

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WIKIPEDIA

HISTRELIN

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

PRIMARY

INN

5733

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

PRIMARY

CHEBI

5739

Created by admin on Fri Dec 15 15:51:50 UTC 2023 , Edited by admin on Fri Dec 15 15:51:50 UTC 2023

PRIMARY

Related Record Type Details


					MJK4KMT12V

GONADOTROPIN-RELEASING HORMONE RECEPTOR

TARGET -> AGONIST

Amount:


					QMG7HLD1ZE

HISTRELIN ACETATE

SALT/SOLVATE -> PARENT

Related Record Type Details


					H50H3S3W74

HISTRELIN

ACTIVE MOIETY