afamelanotide (Q410794)

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chemical compound

α-NDP-MSH
[Nle4,dPhe7]α-MSH
NDP-MSH
MT-I
melanotan 1
melanotan I

Language	Label	Description	Also known as
English	afamelanotide	chemical compound	α-NDP-MSH [Nle4,dPhe7]α-MSH NDP-MSH MT-I melanotan 1 melanotan I

Statements

type of chemical entity

0 references

tryptamine alkaloid

1 reference

based on heuristic

inferred from SMILES

1,645.83651 dalton

1 reference

language of work or name

Afamelanotide (English)

3 October 2016

stereoisomer of

Msh, 4-nle-alpha-

1 reference

based on heuristic

inferred from InChI

chemical formula

C₇₈H₁₁₁N₂₁O₁₉

1 reference

language of work or name

Afamelanotide (English)

3 October 2016

canonical SMILES

CCCCC(C(=O)NC(CCC(=O)O)C(=O)NC(CC1=CN=CN1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CCCNC(=N)N)C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)NCC(=O)NC(CCCCN)C(=O)N5CCCC5C(=O)NC(C(C)C)C(=O)N)NC(=O)C(CO)NC(=O)C(CC6=CC=C(C=C6)O)NC(=O)C(CO)NC(=O)C

1 reference

language of work or name

Afamelanotide (English)

3 October 2016

isomeric SMILES

CCCC[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC1=CN=CN1)C(=O)N[C@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC3=CNC4=CC=CC=C43)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N5CCC[C@H]5C(=O)N[C@@H](C(C)C)C(=O)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC6=CC=C(C=C6)O)NC(=O)[C@H](CO)NC(=O)C

1 reference

language of work or name

Afamelanotide (English)

3 October 2016

active ingredient in

1 reference

European Medicines Agency product number

EMEA/H/C/002548

http://www.ema.europa.eu/ema/index.jsp?curl=pages/medicines/human/medicines/002548/human_med_001826.jsp

22 March 2017

physically interacts with

melanocortin 1 receptor

subject has role

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

language of work or name

17 August 2016

Melanocortin 3 receptor

subject has role

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

language of work or name

17 August 2016

Melanocortin 4 receptor

subject has role

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

language of work or name

17 August 2016

Melanocortin 5 receptor

subject has role

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

language of work or name

17 August 2016

subject has role

dermatologic drug

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

Identifiers

InChI=1S/C78H111N21O19/c1-5-6-19-52(91-75(116)61(41-101)97-72(113)57(34-46-24-26-49(103)27-25-46)94-74(115)60(40-100)88-44(4)102)68(109)92-54(28-29-64(105)106)70(111)96-59(36-48-38-83-42-87-48)73(114)93-56(33-45-16-8-7-9-17-45)71(112)90-53(22-14-31-84-78(81)82)69(110)95-58(35-47-37-85-51-20-11-10-18-50(47)51)67(108)86-39-63(104)89-55(21-12-13-30-79)77(118)99-32-15-23-62(99)76(117)98-65(43(2)3)66(80)107/h7-11,16-18,20,24-27,37-38,42-43,52-62,65,85,100-101,103H,5-6,12-15,19,21-23,28-36,39-41,79H2,1-4H3,(H2,80,107)(H,83,87)(H,86,108)(H,88,102)(H,89,104)(H,90,112)(H,91,116)(H,92,109)(H,93,114)(H,94,115)(H,95,110)(H,96,111)(H,97,113)(H,98,117)(H,105,106)(H4,81,82,84)/t52-,53-,54-,55-,56+,57-,58-,59-,60-,61-,62-,65-/m0/s1

0 references

UAHFGYDRQSXQEB-LEBBXHLNSA-N

1 reference

language of work or name

Afamelanotide (English)

3 October 2016

UAHFGYDRQSXQEB-PWPYQVNISA-N

reason for deprecated rank

cannot be confirmed by other sources

1 reference

ChEBI release 2020-09-01

CAS Registry Number

1 reference

language of work or name

Afamelanotide (English)

3 October 2016

1 reference

language of work or name

Afamelanotide (English)

3 October 2016

2 references

language of work or name

Afamelanotide (English)

3 October 2016

matched by identifier from

UAHFGYDRQSXQEB-LEBBXHLNSA-N

1 reference

matched by identifier from

UAHFGYDRQSXQEB-LEBBXHLNSA-N

1 reference

matched by identifier from

UAHFGYDRQSXQEB-LEBBXHLNSA-N

1 reference

matched by identifier from

UAHFGYDRQSXQEB-LEBBXHLNSA-N

1 reference

matched by identifier from

UAHFGYDRQSXQEB-LEBBXHLNSA-N

mapping relation type

3 references

ChEBI release 2019-10-02

ChEBI release 2021-03-01

matched by identifier from

International Chemical Identifier

InChI=1S/C78H111N21O19/c1-5-6-19-52(91-75(116)61(41-101)97-72(113)57(34-46-24-26-49(103)27-25-46)94-74(115)60(40-100)88-44(4)102)68(109)92-54(28-29-64(105)106)70(111)96-59(36-48-38-83-42-87-48)73(114)93-56(33-45-16-8-7-9-17-45)71(112)90-53(22-14-31-84-78(81)82)69(110)95-58(35-47-37-85-51-20-11-10-18-50(47)51)67(108)86-39-63(104)89-55(21-12-13-30-79)77(118)99-32-15-23-62(99)76(117)98-65(43(2)3)66(80)107/h7-11,16-18,20,24-27,37-38,42-43,52-62,65,85,100-101,103H,5-6,12-15,19,21-23,28-36,39-41,79H2,1-4H3,(H2,80,107)(H,83,87)(H,86,108)(H,88,102)(H,89,104)(H,90,112)(H,91,116)(H,92,109)(H,93,114)(H,94,115)(H,95,110)(H,96,111)(H,97,113)(H,98,117)(H,105,106)(H4,81,82,84)/t52-,53-,54-,55-,56+,57-,58-,59-,60-,61-,62-,65-/m0/s1

1 reference

language of work or name

CHEMBL441738 (English)

3 October 2016

SCHEMBL22463810

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

UAHFGYDRQSXQEB-LEBBXHLNSA-N

SCHEMBL22463811

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

UAHFGYDRQSXQEB-LEBBXHLNSA-N

DSSTox substance ID

2 references

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

matched by identifier from

UAHFGYDRQSXQEB-LEBBXHLNSA-N

DSSTOX compound identifier

0 references

0 references

Guide to Pharmacology Ligand ID

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

language of work or name

afamelanotide (English)

3 October 2016

MeSH descriptor ID

1 reference

Medical Subject Headings

MeSH descriptor ID

14 March 2018

1 reference

matched by identifier from

UAHFGYDRQSXQEB-LEBBXHLNSA-N

2 references

language of work or name

Afamelanotide (English)

3 October 2016

matched by identifier from

UAHFGYDRQSXQEB-LEBBXHLNSA-N

Probes And Drugs ID

0 references

0 references

Microsoft Academic ID

0 references

UK Parliament thesaurus ID

subject named as

Afamelanotide

0 references

1 reference

based on heuristic

inferred by common MeSH mappings on source and on Wikidata

25 May 2023

WikiProjectMed ID

0 references

Sitelinks

Wikipedia(10 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)

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