4-(15) – eudesmene 1β, 5α – diol

4-(15) – eudesmene 1β, 5α – diol
Compound Structure:
Synonyms: 4(15)-eudesmene-1beta,7alpha-diol;(1R,4aS,6S,8aR)-6-isopropyl-8a-methyl-4-methylene-decalin-1,6-diol;(1R,4aS,6S,8aR)-8a-methyl-4-methylidene-6-propan-2-yl-2,3,4a,5,7,8-hexahydro-1H-naphthalene-1,6-diol
Compound ID: NMPC-386
PubChem ID:

11470456
Molecular Formula: C15H26O2
Canonical SMILES: CC(C)C1(CCC2(C(CCC(=C)C2C1)O)C)O
InChIKey: SWIPEIJPNVNEPT-YJNKXOJESA-N
About the compound:
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

238.37 g/mol

XLogP3-AA

2.5

Hydrogen Bond Donor Count

2

Hydrogen Bond Acceptor Count

2

Rotatable Bond Count

1

Exact Mass

238.193280068 g/mol

Monoisotopic Mass

238.193280068 g/mol

Topological Polar Surface Area

40.5Ų

Heavy Atom Count

17

Formal Charge

0

Complexity

323

Isotope Atom Count

0

Defined Atom Stereocenter Count

4

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: Annona muricata
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