α-edesmol

Compound Structure:

Synonyms:

alpha-Eudesmol ;473-16-5; eudesm-3-en-11-ol ;SZ9QGL7BOX ;UNII-SZ9QGL7BOX

Compound ID:

NMPC-1626

PubChem ID:

92762

Molecular Formula:

C15H26O

Canonical SMILES:

CC1=CCCC2(C1CC(CC2)C(C)(C)O)C

InChIKey:

FCSRUSQUAVXUKK-VNHYZAJKSA-N

About the compound:

Alpha-eudesmol is a eudesmanesesquiterpenoid in which the eudesmane skeleton carries a hydroxy substituent at C-11 and has a double bond between C-3 and C-4. It has a role as a volatile oil component. It is a eudesmanesesquiterpenoid, a member of octahydronaphthalenes and a tertiary alcohol.

Properties:

Chemical and Physical Properties

Property Name	Property Value
Molecular Weight	222.37 g/mol
XLogP3-AA	3.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	222.198365449 g/mol
Monoisotopic Mass	222.198365449 g/mol
Topological Polar Surface Area	20.2Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	303
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
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:

Eucalyptus cloeziana

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