Curassavinine structure

Curassavinine

5,6,7,8-tetrahydro-3H-pyrrolizin-1-ylmethyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylpentanoate

Also Known As: Curassavinine|Pentanoic acid, 2-hydroxy-2-(1-hydroxyethyl)-3-methyl-, (2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl)methyl ester|5,6,7,8-tetrahydro-3H-pyrrolizin-1-ylmethyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylpentanoate|(2,3,5,7a-Tetrahydro-1H-pyrrolizin-7-yl)methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylpentanoate|2-Hydroxy-2- -3-methylpentanoicacid[[5,6,7,7a-tetrahydro-3H-pyrrolizin]-1-ylmethyl]ester|ACETANILIDE, N-(3-(DIMETHYLAMINO)-2-METHYLPROPYL)-2',6'-DIMETHYL-2-PHENYL-|2-Hydroxy-2-(1-hydroxyethyl)-3-methylpentanoic acid [[5,6,7,7a-tetrahydro-3H-pyrrolizin]-1-ylmethyl] ester

CAS: 84306-92-3
Molecular Formula C16H27NO4
Molecular Weight 297.194 g/mol
LogP 0.9
Topological Polar Surface Area 70.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 297.194
Monoisotopic Mass 297.194
Heavy Atoms 21
Complexity 423.0

Chemical Identifiers

CAS Number 84306-92-3
SMILES CCC(C)C(C(C)O)(C(=O)OCC1=CCN2C1CCC2)O
InChIKey WNDKUMUAOQFAGL-UHFFFAOYSA-N

Product Overview

Curassavinine (CAS 84306-92-3), with molecular formula C16H27NO4 and molecular weight 297.194 g/mol. IUPAC: 5,6,7,8-tetrahydro-3H-pyrrolizin-1-ylmethyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylpentanoate.

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