flucloronide (Q5462615)

DrugBank

image of molecular model or crystal lattice model

17 November 2015

Fluclorolone acetonide.png
1,087 × 588; 114 KB

depicts

ball-and-stick model

0 references

mass

486.138 dalton

1 reference

Fluclorolone acetonide (English)

17 November 2016

chemical formula

C₂₄H₂₉Cl₂FO₅

1 reference

Fluclorolone acetonide (English)

17 November 2016

canonical SMILES

CC1(OC2CC3C4CC(C5=CC(=O)C=CC5(C4(C(CC3(C2(O1)C(=O)CO)C)Cl)Cl)C)F)C

1 reference

Fluclorolone acetonide (English)

17 November 2016

isomeric SMILES

C[C@]12C[C@@H]([C@]3([C@H]([C@@H]1C[C@@H]4[C@]2(OC(O4)(C)C)C(=O)CO)C[C@@H](C5=CC(=O)C=C[C@@]53C)F)Cl)Cl

1 reference

Fluclorolone acetonide (English)

InChI=1S/C24H29Cl2FO5/c1-20(2)31-19-9-13-14-8-16(27)15-7-12(29)5-6-21(15,3)23(14,26)17(25)10-22(13,4)24(19,32-20)18(30)11-28/h5-7,13-14,16-17,19,28H,8-11H2,1-4H3/t13-,14-,16-,17-,19+,21-,22-,23-,24+/m0/s1

17 November 2016

Identifiers

InChI

1 reference

Fluclorolone acetonide (English)

17 November 2016

2 references

Fluclorolone acetonide (English)

17 November 2016

ChEBI release 2020-09-01

CAS Registry Number

3693-39-8

2 references

flucloronide (English)

17 November 2016

https://commonchemistry.cas.org/detail?cas_rn=3693-39-8

10 April 2021

1 reference

6a-Fluoro-9a,11b-dichloro-1,4-pregnadiene-16a,17,21-triol-3,20-dione 16,17-Acetonide (English)

17 November 2016

2 references

Fluclorolone acetonide (English)

17 November 2016

ChEBI ID

135787

mapping relation type

exact match

2 references

ChEBI release 2019-10-02

International Chemical Identifier

InChI

InChI=1S/C24H29Cl2FO5/c1-20(2)31-19-9-13-14-8-16(27)15-7-12(29)5-6-21(15,3)23(14,26)17(25)10-22(13,4)24(19,32-20)18(30)11-28/h5-7,13-14,16-17,19,28H,8-11H2,1-4H3/t13-,14-,16-,17-,19+,21-,22-,23-,24+/m0/s1

1 reference

FLUCLORONIDE (English)

17 November 2016

2 references

inferred from InChIKey

1 reference

1 reference

EC number

223-010-9

1 reference

flucloronide (English)

ECHA Substance Infocard ID

17 November 2016

100.020.919

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.020.919

27 December 2018

Fluclorolone acetonide (English)

quotation

CAS no.: 3693-39-8 (English)

RxNorm ID

103447

1 reference

flucloronide (English)

17 November 2016

DrugBank ID

DB08973

1 reference

2 references

flucloronide (English)

17 November 2016