Acebrochol

Acebrochol
Clinical data
ATC code	none;
Identifiers
	IUPAC name [(4S,6R,8S,9S,10R,13R,14S,17R)-4,6-dibromo-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate;
CAS Number	514-50-1 ;
PubChem CID	10952056;
ChemSpider	9127276 ;
UNII	7XZB016MY5;
ChEMBL	ChEMBL2104033 ;
Chemical and physical data
Formula	C29H48Br2O2
Molar mass	588.509 g·mol−1
3D model (JSmol)	Interactive image;
	SMILES C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H]([C@@]4([C@@]3(CC[C@@H](C4)OC(=O)C)C)Br)Br)C;
	InChI InChI=1S/C29H48Br2O2/c1-18(2)8-7-9-19(3)23-10-11-24-22-16-26(30)29(31)17-21(33-20(4)32)12-15-28(29,6)25(22)13-14-27(23,24)5/h18-19,21-26H,7-17H2,1-6H3/t19-,21+,22+,23-,24+,25+,26-,27-,28-,29+/m1/s1 ; Key:ISLUIHYFJMYECW-BSMCXZHXSA-N ;
	(what is this?) (verify)

Acebrochol (INN),^[1] also known as cholesteryl acetate dibromide or 5α,6β-dibromocholestan-3β-ol acetate, is a neuroactive steroid which was described as a sedative and hypnotic but was never marketed.^[2]

Chemistry

References

^ "INN - acebrochol". Mednet. Whorld Health Organisation (WHO). Retrieved 10 August 2015.
^ Hill RA, Makin HL, Kirk DN, Murphy GM (23 May 1991). Dictionary of Steroids. CRC Press. pp. 229–. ISBN 978-0-412-27060-4.

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[1] "INN - acebrochol". Mednet. Whorld Health Organisation (WHO). Retrieved 10 August 2015.

[HillMakin1991-2] Hill RA, Makin HL, Kirk DN, Murphy GM (23 May 1991). Dictionary of Steroids. CRC Press. pp. 229–. ISBN 978-0-412-27060-4.

[1]

[2]

Clinical data

ATC code	none
Identifiers
IUPAC name [(4S,6R,8S,9S,10R,13R,14S,17R)-4,6-dibromo-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
CAS Number	514-50-1^Y
PubChem CID	10952056
ChemSpider	9127276^N
UNII	7XZB016MY5
ChEMBL	ChEMBL2104033^N
Chemical and physical data
Formula	C₂₉H₄₈Br₂O₂
Molar mass	588.509 g·mol⁻¹
3D model (JSmol)	Interactive image
SMILES C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H]([C@@]4([C@@]3(CC[C@@H](C4)OC(=O)C)C)Br)Br)C
InChI InChI=1S/C29H48Br2O2/c1-18(2)8-7-9-19(3)23-10-11-24-22-16-26(30)29(31)17-21(33-20(4)32)12-15-28(29,6)25(22)13-14-27(23,24)5/h18-19,21-26H,7-17H2,1-6H3/t19-,21+,22+,23-,24+,25+,26-,27-,28-,29+/m1/s1^N Key:ISLUIHYFJMYECW-BSMCXZHXSA-N^N
^NY (what is this?) (verify)

Acebrochol

Chemistry

See also

References