cloprostenol (Q27076117)

cloprostenol (English)

7-[(1R,2R,3R,5S)-2-[(3R)-4-(3-chlorophenoxy)-3-hydroxybut-1-enyl]-3,5-dihydroxycyclopentyl]-5-heptenoic acid

3 October 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₂H₂₉ClO₆

1 reference

cloprostenol (English)

3 October 2016

canonical SMILES

C1C(C(C(C1O)C=CC(COC2=CC(=CC=C2)Cl)O)CC=CCCCC(=O)O)O

1 reference

cloprostenol (English)

3 October 2016

isomeric SMILES

C1[C@@H]([C@@H]([C@H]([C@@H]1O)/C=C/[C@H](COC2=CC(=CC=C2)Cl)O)C/C=C\CCCC(=O)O)O

1 reference

cloprostenol (English)

3 October 2016

1 reference

Medical Subject Headings

MeSH descriptor ID

D003008

InChI=1S/C22H29ClO6/c23-15-6-5-7-17(12-15)29-14-16(24)10-11-19-18(20(25)13-21(19)26)8-3-1-2-4-9-22(27)28/h1,3,5-7,10-12,16,18-21,24-26H,2,4,8-9,13-14H2,(H,27,28)/b3-1-,11-10+/t16-,18-,19-,20+,21-/m1/s1

15 March 2018

Identifiers

InChI

1 reference

cloprostenol (English)

3 October 2016

1 reference

cloprostenol (English)

3 October 2016

0 references

1 reference

Estrofan (English)

3 October 2016

2 references

cloprostenol (English)

3 October 2016

ChEBI ID

177470

mapping relation type

exact match

2 references

ChEBI release 2022-06-13

International Chemical Identifier

InChI

InChI=1S/C22H29ClO6/c23-15-6-5-7-17(12-15)29-14-16(24)10-11-19-18(20(25)13-21(19)26)8-3-1-2-4-9-22(27)28/h1,3,5-7,10-12,16,18-21,24-26H,2,4,8-9,13-14H2,(H,27,28)/b3-1-,11-10+/t16-,18-,19-,20+,21-/m1/s1

1 reference

CLOPROSTENOL (English)

3 October 2016

2 references

inferred from InChIKey

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

1 reference

1 reference

DTXSID50860575

1 reference

DSSTOX compound identifier

DTXCID3028346

0 references

EC number

255-028-8

0 references

ECHA Substance Infocard ID

100.050.009

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.050.009

29 December 2019

AICS Chemical ID (BEING DELETED)

Cloprostenol (English)

quotation

CAS no.: 40665-92-7 (English)

19057

0 references

Guide to Pharmacology Ligand ID

1894

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

1894

cloprostenol (English)

3 October 2016

Cloprostenol

1 reference

D10.251.355.255.550.775.500.175

Medical Subject Headings

14 March 2018

0 references

D23.469.050.175.725.775.500.175

0 references

D23.469.700.670.175

0 references

DrugBank ID

DB11507

1 reference

UNII

4208238832

1 reference

52EJR3Y9IN

1 reference

Google Knowledge Graph ID

0 references

0 references

/g/11c59wgm6h

0 references

Microsoft Academic ID

0 references

0 references

1 reference

26 January 2022

https://docs.openalex.org/download-snapshot/snapshot-data-format

YSO ID

38619

subject named as

kloprostenoli

kloprostenol

cloprostenol

1 reference

YSO-Wikidata mapping project