fluazacort (Q27294212)

UNII-Y37GZ3VFSS (English)

14 October 2016

chemical formula

C₂₅H₃₀FNO₆

1 reference

UNII-Y37GZ3VFSS (English)

14 October 2016

canonical SMILES

CC1=NC2(C(O1)CC3C2(CC(C4(C3CCC5=CC(=O)C=CC54C)F)O)C)C(=O)COC(=O)C

1 reference

UNII-Y37GZ3VFSS (English)

14 October 2016

isomeric SMILES

CC1=N[C@@]2([C@H](O1)C[C@@H]3[C@@]2(C[C@@H]([C@]4([C@H]3CCC5=CC(=O)C=C[C@@]54C)F)O)C)C(=O)COC(=O)C

1 reference

UNII-Y37GZ3VFSS (English)

InChI=1S/C25H30FNO6/c1-13-27-25(20(31)12-32-14(2)28)21(33-13)10-18-17-6-5-15-9-16(29)7-8-22(15,3)24(17,26)19(30)11-23(18,25)4/h7-9,17-19,21,30H,5-6,10-12H2,1-4H3/t17-,18-,19-,21+,22-,23-,24-,25+/m0/s1

14 October 2016

Identifiers

InChI

1 reference

UNII-Y37GZ3VFSS (English)

14 October 2016

2 references

UNII-Y37GZ3VFSS (English)

14 October 2016

ChEBI release 2020-09-01

CAS Registry Number

19888-56-3

1 reference

Global Substance Registration System

fluazacort (English)

14 October 2016

1 reference

Azacortid (English)

14 October 2016

2 references

UNII-Y37GZ3VFSS (English)

14 October 2016

ChEBI ID

135743

mapping relation type

exact match

2 references

ChEBI release 2019-10-02

International Chemical Identifier

InChI

InChI=1S/C25H30FNO6/c1-13-27-25(20(31)12-32-14(2)28)21(33-13)10-18-17-6-5-15-9-16(29)7-8-22(15,3)24(17,26)19(30)11-23(18,25)4/h7-9,17-19,21,30H,5-6,10-12H2,1-4H3/t17-,18-,19-,21+,22-,23-,24-,25+/m0/s1

1 reference

FLUAZACORT (English)

14 October 2016

2 references

inferred from InChIKey

1 reference

243-400-2

1 reference

Global Substance Registration System

fluazacort (English)

ECHA Substance Infocard ID

14 October 2016

100.039.440

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

Fluazacort (English)

CAS no.: 19888-56-3 (English)

2 references

Global Substance Registration System

fluazacort (English)

14 October 2016