α-Ylangene

Compound Structure:

Synonyms:

alpha-Ylangene; (1S)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene; CHEBI:10341; C09749

Compound ID:

NMPC-1639

PubChem ID:

Molecular Formula:

C15H24

Canonical SMILES:

CC1=CCC2C3C1C2(CCC3C(C)C)C

InChIKey:

VLXDPFLIRFYIME-MWHZVNNOSA-N

About the compound:

Properties:

Computed Properties

Property Name	Property Value
Molecular Weight	204.35 g/mol
XLogP3-AA	4.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	204.187800766 g/mol
Monoisotopic Mass	204.187800766 g/mol
Topological Polar Surface Area	0Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	312
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	4
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Source:PubChem

Source Species:

Boswellia dalzielii
Eucalyptus tereticornis
Hyparrhenia rufa
Eucalyptus torelliana

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