Beta Costol

Beta Costol
Compound Structure:
Synonyms: Costol;Sesquibenihiol;(+)-.beta.-Costol;515-20-8;b-Costol;.beta.-Costol;(+)-Costol;CHEBI:195975; -N;Eudesma-4(14),11(13)-dien-12-ol;Q67879720;2-((2R,4aR,8aS)-4a-Methyl-8-methylenedecahydronaphthalen-2-yl)prop-2-en-1-ol
Compound ID: NMPC-654
PubChem ID:

12304104
Molecular Formula: C15H24O
Canonical SMILES: CC12CCCC(=C)C1CC(CC2)C(=C)CO
InChIKey: FKWGZOFNSIESOX-UHFFFAOYSA-N
About the compound:
Properties:

Chemical and Physical Properties

Computed Properties

Property Name

Property Value

Molecular Weight

220.35 g/mol

XLogP3-AA

4.2

Hydrogen Bond Donor Count

1

Hydrogen Bond Acceptor Count

1

Rotatable Bond Count

2

Exact Mass

220.182715385 g/mol

Monoisotopic Mass

220.182715385 g/mol

Topological Polar Surface Area

20.2Ų

Heavy Atom Count

16

Formal Charge

0

Complexity

305

Isotope Atom Count

0

Defined Atom Stereocenter Count

0

Undefined Atom Stereocenter Count

3

Defined Bond Stereocenter Count

0

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Source: PubChem                                                                                             
Source Species: Pentaclethra macrophylla
Pteris togoensis
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