Olean-13(18)-ene

Olean-13(18)-ene
Compound Structure:
Synonyms: (4aS,6aR,6bS,8aR,14aR,14bS)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,13,14,14a-tetradecahydropicene; Olean-13(18)-ene.
Compound ID: NMPC-1358
PubChem ID:

13857720
Molecular Formula: C30H50
Canonical SMILES: CC1(CCC2(CCC3(C(=C2C1)CCC4C3(CCC5C4(CCCC5(C)C)C)C)C)C)C
InChIKey: GNSWPULAOZONLL-RBXQBWMISA-N
About the compound:
Properties:

Chemical and Physical Properties

Computed Properties

Property Name

Property Value

Molecular Weight

410.7 g/mol

XLogP3-AA

10.4

Hydrogen Bond Donor Count

0

Hydrogen Bond Acceptor Count

0

Rotatable Bond Count

0

Exact Mass

410.391251595 g/mol

Monoisotopic Mass

410.391251595 g/mol

Topological Polar Surface Area

0Ų

Heavy Atom Count

30

Formal Charge

0

Complexity

767

Isotope Atom Count

0

Defined Atom Stereocenter Count

6

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: Phyllanthus amarus
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