2'-norcocsuline

2'-norcocsuline
Compound Structure:
Synonyms: (+)-2'-norcocsuline;CHEMBL443331
Compound ID: NMPC-275
PubChem ID:

44559018
Molecular Formula: C34H32N2O5
Canonical SMILES: CN1CCC2=CC3=C4C=C2C1CC5=CC(=C(C=C5)O)OC6=CC=C(CC7C8=C(O4)C(=C(C=C8CCN7)OC)O3)C=C6
InChIKey: AVICOTFUCGWABJ-UIOOFZCWSA-N
About the compound:
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

548.6 g/mol

XLogP3-AA

5.5

Hydrogen Bond Donor Count

2

Hydrogen Bond Acceptor Count

7

Rotatable Bond Count

1

Exact Mass

548.23112213 g/mol

Monoisotopic Mass

548.23112213 g/mol

Topological Polar Surface Area

72.4Ų

Heavy Atom Count

41

Formal Charge

0

Complexity

914

Isotope Atom Count

0

Defined Atom Stereocenter Count

2

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: Triclisia subcordata
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