4Alpha-Methyl-5Alpha-Cholest-8-En-3Beta-Ol

Representations & DB's id
ChEBI:	CHEBI:87051
ChEMBL:	CHEMBL489539
PubChem:	6452640
IUPAC:	(3S,4S,5S,10S,13R,14R,17R)-4,10,13-trimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Standard InChI:	InChI=1S/C28H48O/c1-18(2)8-7-9-19(3)22-12-13-24-21-10-11-23-20(4)26(29)15-17-28(23,6)25(21)14-16-27(22,24)5/h18-20,22-24,26,29H,7-17H2,1-6H3/t19-,20+,22-,23+,24+,26+,27-,28+/m1/s1
Standard InChI Key:	SCEZIHJVTBQOLS-YIJYGBTNSA-N
SMILES:	CC(CCC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CCC1=C2CC[C@@H]2[C@]1(C)CC[C@@H]([C@H]2C)O)C)C

Molecular propeties
AlogP:	7.78
Hydrogen bonds acceptors:	1
Hydrogen bonds donors:	1
Rotatable bonds:	5
Number of rings:	4
Molecular Weight:	400.37
Topological polar surface area:	20.2
Number of aromatic rings:	0
Fsp3:	0.929
Number of carbons:	28

Plant sources

Part of plant	Plant name	Ref.
Plant	Archangelica officinalis

In vitro data

Activity Type	Activity Value	Target Name	UniProt ID	Ref.