UNPD10936
AlkaPlorer ID: AK180776
Synonym: None
IUPAC Name: [(1R,2R,4S,8S)-2-hydroxy-4-oxido-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl (Z)-2-methylbut-2-enoate
Structure
SMILES: C/C=C(/C)C(=O)OC[C@@H]1[C@@H](O)C[N@@+]2([O-])CCC[C@@H]12
InChI: InChI=1S/C13H21NO4/c1-3-9(2)13(16)18-8-10-11-5-4-6-14(11,17)7-12(10)15/h3,10-12,15H,4-8H2,1-2H3/b9-3-/t10-,11-,12-,14-/m0/s1
InChIKey: YQESXLVASGRVDC-VSZQWRSVSA-N
Reference
A Benzylisoquinoline Alkaloid from <i>Doryphora</i> <i>s</i><i>assafras</i>
PubChem CID: 162812210
SuperNatural Ⅲ: SN0457354-01
Source
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Properties Information
Molecule Weight: 255.314
TPSA？: 69.59
MolLogP？: 0.9634999999999996
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 2
Activities Information
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