THC Science

Obtusifoliol
Identifiers
CAS Number	16910-32-0;
3D model (JSmol)	Interactive image;
3DMet	B01524;
ChEBI	CHEBI:17791;
ChEMBL	ChEMBL1978954;
ChemSpider	167937;
KEGG	C01943;
PubChem CID	5047;
UNII	3RH57E39ER;
CompTox Dashboard (EPA)	DTXSID60168650 ;
	InChI InChI=1S/C30H50O/c1-19(2)20(3)9-10-21(4)23-13-17-30(8)26-12-11-24-22(5)27(31)15-16-28(24,6)25(26)14-18-29(23,30)7/h19,21-24,27,31H,3,9-18H2,1-2,4-8H3/t21-,22+,23-,24?,27+,28+,29-,30+/m1/s1 Key: MMNYKQIDRZNIKT-YLANKJTKSA-N; InChI=1S/C30H50O/c1-19(2)20(3)9-10-21(4)23-13-17-30(8)26-12-11-24-22(5)27(31)15-16-28(24,6)25(26)14-18-29(23,30)7/h19,21-24,27,31H,3,9-18H2,1-2,4-8H3/t21-,22+,23-,24?,27+,28+,29-,30+/m1/s1 Key: MMNYKQIDRZNIKT-YLANKJTKSA-N;
	SMILES C[C@@H]1[C@H](CC[C@]2(C1CCC3=C2CC[C@]4([C@]3(CC[C@@H]4[C@H](C)CCC(=C)C(C)C)C)C)C)O;
Properties
Chemical formula	C30H50O
Molar mass	426.729 g·mol−1
	Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa). Infobox references

Obtusifoliol is a metabolic intermediate of sterols made by certain fungi. It can be converted to delta8,14-sterol by the enzyme ERG11 (CYP51F1).^[1]

References[edit]

^ Park, HG; Lee, IS; Chun, YJ; Yun, CH; Johnston, JB; Montellano, PR; Kim, D (1 May 2011). "Heterologous expression and characterization of the sterol 14α-demethylase CYP51F1 from Candida albicans". Archives of Biochemistry and Biophysics. 509 (1): 9–15. doi:10.1016/j.abb.2011.02.002. PMC 3079055. PMID 21315684.

Identifiers

CAS Number	16910-32-0
3D model (JSmol)	Interactive image
3DMet	B01524
ChEBI	CHEBI:17791
ChEMBL	ChEMBL1978954
ChemSpider	167937
KEGG	C01943
PubChem CID	5047
UNII	3RH57E39ER
CompTox Dashboard (EPA)	DTXSID60168650
InChI InChI=1S/C30H50O/c1-19(2)20(3)9-10-21(4)23-13-17-30(8)26-12-11-24-22(5)27(31)15-16-28(24,6)25(26)14-18-29(23,30)7/h19,21-24,27,31H,3,9-18H2,1-2,4-8H3/t21-,22+,23-,24?,27+,28+,29-,30+/m1/s1 Key: MMNYKQIDRZNIKT-YLANKJTKSA-N InChI=1S/C30H50O/c1-19(2)20(3)9-10-21(4)23-13-17-30(8)26-12-11-24-22(5)27(31)15-16-28(24,6)25(26)14-18-29(23,30)7/h19,21-24,27,31H,3,9-18H2,1-2,4-8H3/t21-,22+,23-,24?,27+,28+,29-,30+/m1/s1 Key: MMNYKQIDRZNIKT-YLANKJTKSA-N
SMILES C[C@@H]1[C@H](CC[C@]2(C1CCC3=C2CC[C@]4([C@]3(CC[C@@H]4[C@H](C)CCC(=C)C(C)C)C)C)C)O
Properties
Chemical formula	C₃₀H₅₀O
Molar mass	426.729 g·mol⁻¹
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa). Infobox references