Curzerene

CAT: 0607-BA2857-5Size: 5x 1 mgDry Ice: NoHazardous: No

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CAT#:0607-BA2857-5Size:5x 1 mg

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CAS Number

17910-09-7

Form

A liquid

Molecular Formula

C15H20O

Molecular Weight

216.32

Shipping Conditions

Blue ice

Storage Conditions

-20°C, protect from light.

Chemical Information

Curzerene

Curzerene has been reported in Lindera pulcherrima var. hemsleyana, Commiphora myrrha, and Lindera with data available.

CAS Number	17910-09-7
PubChem CID	165365640
IUPAC Name	(5R,6R)-6-ethyl-3,6-dimethyl-5-prop-1-en-2-yl-5,7-dihydro-4H-1-benzofuran
Molecular Formula	C15H22O
Molecular Weight	218.33
XLogP	4.9
Topological Polar Surface Area	13.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	16
Formal Charge	0
Complexity	283

SMILES

CC[C@@]1(CC2=C(C[C@@H]1C(=C)C)C(=CO2)C)C

InChI

InChI=1S/C15H22O/c1-6-15(5)8-14-12(11(4)9-16-14)7-13(15)10(2)3/h9,13H,2,6-8H2,1,3-5H3/t13-,15-/m1/s1

InChIKey

SLEDFMXZSQPLHT-UKRRQHHQSA-N

Chemical Structure

2D Structure

CAS: 17910-09-7

CID: 165365640

Formula: C15H22O

MW: 218.33

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	218.33
XLogP3	4.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	218.167065321
Monoisotopic Mass	218.167065321
Topological Polar Surface Area	13.1 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	283
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
BA1340-5	Curzerenone
BA1340-1	Curzerenone