kaurene

Compound Structure:

Synonyms:

(1R,4S,9S,10S,13S)-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane; (-)-Kaurene; Kaur-16-ene

Compound ID:

NMPC-1183

PubChem ID:

Molecular Formula:

C20H32

Canonical SMILES:

CC1(CCCC2(C1CCC34C2CCC(C3)C(=C)C4)C)C

InChIKey:

ONVABDHFQKWOSV-GCLMUHHRSA-N

About the compound:

Properties:

Chemical and Physical Properties

Computed Properties

Property Name	Property Value
Molecular Weight	272.5 g/mol
XLogP3-AA	6.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	272.250401021 g/mol
Monoisotopic Mass	272.250401021 g/mol
Topological Polar Surface Area	0Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	445
Isotope Atom Count	0
Defined Atom Stereocenter Count	5
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Source: PubChem

Source Species:

Xylopia aethiopica
Araucaria cunninghamii

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