Cerebroside

Cerebroside
Compound Structure:
Synonyms: Cerebroside E;CHEMBL3736367
Compound ID: NMPC-740
PubChem ID:

127034832
Molecular Formula: C40H75NO9
Canonical SMILES: CCCCCCCCCCCCCCCCC(C(=O)NC(COC1C(C(C(C(O1)CO)O)O)O)C(C=CCCC=C(C)CCCCCC)O)O
InChIKey: DNLCQLXPBPKXTD-UGYAIEHASA-N
About the compound:
Properties:

Chemical and Physical Properties

Computed Properties

Property Name

Property Value

Molecular Weight

714.0 g/mol

XLogP3-AA

9.7

Hydrogen Bond Donor Count

7

Hydrogen Bond Acceptor Count

9

Rotatable Bond Count

31

Exact Mass

713.54418297 g/mol

Monoisotopic Mass

713.54418297 g/mol

Topological Polar Surface Area

169Ų

Heavy Atom Count

50

Formal Charge

0

Complexity

885

Isotope Atom Count

0

Defined Atom Stereocenter Count

8

Undefined Atom Stereocenter Count

0

Defined Bond Stereocenter Count

2

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Source: PubChem                                                                                             
Source Species: Dacryodes edulis
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