seliciclib (Q3494619)

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chemical compound

(R)-roscovitine
CYC-202
CYC202
R-roscovitine
roscovitine
(2R)-2-{[6-(benzylamino)-9-(1-methylethyl)-9H-purin-2-yl]amino}butan-1-ol
2-(R)-(1-ethyl-2-hydroxyethylamino)-6-benzylamino-9-isopropylpurine
(2R)-2-((9-(1-methylethyl)-6-((phenylmethyl)amino)-9H-purin-2-yl)amino)-1-butanol
(R)-2-((9-(1-methylethyl)-6-((phenylmethyl)amino)-9H-purin-2-yl)amino)-1-butanol
Seliciclib

Language	Label	Description	Also known as
English	seliciclib	chemical compound	(R)-roscovitine CYC-202 CYC202 R-roscovitine roscovitine (2R)-2-{[6-(benzylamino)-9-(1-methylethyl)-9H-purin-2-yl]amino}butan-1-ol 2-(R)-(1-ethyl-2-hydroxyethylamino)-6-benzylamino-9-isopropylpurine (2R)-2-((9-(1-methylethyl)-6-((phenylmethyl)amino)-9H-purin-2-yl)amino)-1-butanol (R)-2-((9-(1-methylethyl)-6-((phenylmethyl)amino)-9H-purin-2-yl)amino)-1-butanol Seliciclib

Statements

type of chemical entity

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chemical compound

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chemical structure

Seliciclib.PNG
1,113 × 1,265; 9 KB

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354.217 dalton

1 reference

language of work or name

roscovitine (English)

19 October 2016

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₉H₂₆N₆O

1 reference

language of work or name

roscovitine (English)

19 October 2016

canonical SMILES

CCC(CO)NC1=NC2=C(C(=N1)NCC3=CC=CC=C3)N=CN2C(C)C

1 reference

language of work or name

roscovitine (English)

19 October 2016

isomeric SMILES

CC[C@H](CO)NC1=NC2=C(C(=N1)NCC3=CC=CC=C3)N=CN2C(C)C

1 reference

language of work or name

roscovitine (English)

19 October 2016

World Health Organisation international non-proprietary name

seliciclib (English)

1 reference

language of work or name

seliciclib (English)

19 October 2016

Ophioparma ventosa

1 reference

Minor Pyranonaphthoquinones from the Apothecia of the Lichen Ophioparma ventosa

1 reference

Microxine, a new cdc2 kinase inhibitor from the Australian marine sponge Microxina species.

physically interacts with

Cyclin dependent kinase 2

subject has role

enzyme inhibitor

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

language of work or name

17 August 2016

Cyclin dependent kinase 9

subject has role

enzyme inhibitor

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

language of work or name

17 August 2016

subject has role

protein kinase inhibitors

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

Identifiers

InChI=1S/C19H26N6O/c1-4-15(11-26)22-19-23-17(20-10-14-8-6-5-7-9-14)16-18(24-19)25(12-21-16)13(2)3/h5-9,12-13,15,26H,4,10-11H2,1-3H3,(H2,20,22,23,24)/t15-/m1/s1

1 reference

language of work or name

roscovitine (English)

19 October 2016

BTIHMVBBUGXLCJ-OAHLLOKOSA-N

2 references

language of work or name

roscovitine (English)

19 October 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

language of work or name

seliciclib (English)

19 October 2016

BTIHMVBBUGXLCJ-OAHLLOKOSA-N

CAS Common Chemistry

10 April 2021

https://commonchemistry.cas.org/detail?cas_rn=186692-46-6

1 reference

language of work or name

Seliciclib (English)

19 October 2016

1 reference

language of work or name

roscovitine (English)

19 October 2016

Reaxys registry number

7694281

1 reference

language of work or name

seliciclib (English)

19 October 2016

mapping relation type

2 references

language of work or name

seliciclib (English)

19 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C19H26N6O/c1-4-15(11-26)22-19-23-17(20-10-14-8-6-5-7-9-14)16-18(24-19)25(12-21-16)13(2)3/h5-9,12-13,15,26H,4,10-11H2,1-3H3,(H2,20,22,23,24)/t15-/m1/s1

1 reference

language of work or name

SELICICLIB (English)

19 October 2016

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

BTIHMVBBUGXLCJ-OAHLLOKOSA-N

UniChem compound ID

1 reference

DSSTox substance ID

1 reference

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

DSSTOX compound identifier

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Guide to Pharmacology Ligand ID

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

language of work or name

seliciclib (English)

19 October 2016

MeSH descriptor ID

subject named as

Roscovitine

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D03.633.100.759.776

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1 reference

language of work or name

Seliciclib (English)

publication date

3 July 2018

2 references

Global Substance Registration System

language of work or name

seliciclib (English)

19 October 2016

matched by identifier from

BTIHMVBBUGXLCJ-OAHLLOKOSA-N

Probes And Drugs ID

0 references

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LINCS small molecule ID

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1 reference

Freebase Data Dumps

publication date

28 October 2013

Microsoft Academic ID

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NCI Drug Dictionary ID

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PDB structure ID

1 reference

Protein Data Bank

PDB structure ID

language of work or name

3DDQ (English)

19 October 2016

1 reference

Protein Data Bank

PDB structure ID

language of work or name

1UNL (English)

19 October 2016

1 reference

Protein Data Bank

PDB structure ID

language of work or name

1YGK (English)

19 October 2016

1 reference

Protein Data Bank

PDB structure ID

language of work or name

2A4L (English)

19 October 2016

1 reference

based on heuristic

inferred by common MeSH mappings on source and on Wikidata

25 May 2023

Sitelinks

Wikipedia(7 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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