Curcolone

CAT: 0926-SAA01543-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0926-SAA01543-02Size:25 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

17015-43-9

Smiles

CC (=O) C1=CN=C (O1) N (C) C

Molecular Formula

C15H18O3

Molecular Weight

246.30 g/mol

Controlled

Chemical Information

Curcolone

Curcolone is a sesquiterpenoid.

CAS Number	17015-43-9
PubChem CID	5316208
IUPAC Name	8-hydroxy-3,5,8a-trimethyl-6,7,8,9-tetrahydrobenzo[f][1]benzofuran-4-one
Molecular Formula	C15H18O3
Molecular Weight	246.30
XLogP	2
Topological Polar Surface Area	50.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	18
Formal Charge	0
Complexity	425

SMILES

CC1=C2C(=O)C3=C(CC2(C(CC1)O)C)OC=C3C

InChI

InChI=1S/C15H18O3/c1-8-4-5-11(16)15(3)6-10-12(9(2)7-18-10)14(17)13(8)15/h7,11,16H,4-6H2,1-3H3

InChIKey

PFIXJSCFTAVWBW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 17015-43-9

CID: 5316208

Formula: C15H18O3

MW: 246.30

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	246.30
XLogP3	2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	246.125594432
Monoisotopic Mass	246.125594432
Topological Polar Surface Area	50.4 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	425
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
SIA81709-01	Curcolonol

Catalog	Name
379940	Curcolone