funtumidine

Compound Structure:

Synonyms:

3-alpha-Aminoallopregnan-20-ol; 3-alpha-Amino-5-alpha-pregnan-20-alpha-ol; Pregnan-20-ol, 3-amino-, (3-alpha,5-alpha,20S)-; 5-alpha-Pregnan-20-alpha-ol, 3-alpha-amino-

Compound ID:

NMPC-1060

PubChem ID:

101701

Molecular Formula:

C21H37NO

Canonical SMILES:

CC(C1CCC2C1(CCC3C2CCC4C3(CCC(C4)N)C)C)O

InChIKey:

VIQFMADXQMGZER-CGVINKDUSA-N

About the compound:

Properties:

Chemical and Physical Properties

Computed Properties

Property Name	Property Value
Molecular Weight	319.5 g/mol
XLogP3-AA	4.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	319.287514804 g/mol
Monoisotopic Mass	319.287514804 g/mol
Topological Polar Surface Area	46.2Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	465
Isotope Atom Count	0
Defined Atom Stereocenter Count	9
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:

Funtumia africana

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