Alloaromadendrene

Alloaromadendrene
Compound Structure:
Synonyms: Alloaromadendrene;(-)-Alloaromadendrene;25246-27-9;(1aR,4aS,7R,7aR,7bS)-1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene;(-)-allo-Aromadendrene;6-Methoxysalicylicacid;ALLOAKUMADENDRENE
Compound ID: NMPC-568
PubChem ID:

10899740

Molecular Formula: C15H24
Canonical SMILES: CC1CCC2C1C3C(C3(C)C)CCC2=C
InChIKey: ITYNGVSTWVVPIC-DHGKCCLASA-N
About the compound:
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

204.35 g/mol

XLogP3-AA

4.7

Hydrogen Bond Donor Count

0

Hydrogen Bond Acceptor Count

0

Rotatable Bond Count

0

Exact Mass

204.187800766 g/mol

Monoisotopic Mass

204.187800766 g/mol

Topological Polar Surface Area

0Ų

Heavy Atom Count

15

Formal Charge

0

Complexity

299

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 Species: Gongronema latifolium
Zingiber officinale
Araucaria cunninghamii
Eucalyptus cloeziana
Eucalyptus tereticornis
Tagetes erecta
Eugenia uniflora
Murraya Koenigii
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