Chemical Properties of 9-Angeloylretronecine

9-Angeloylretronecine

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InChI
InChI=1S/C13H19NO3/c1-3-9(2)13(16)17-8-10-4-6-14-7-5-11(15)12(10)14/h3-4,11-12,15H,5-8H2,1-2H3/b9-3-/t11-,12+/m1/s1
InChI Key
VYUQPLFRNDQDHW-KKXNAPIPSA-N
Formula
C13H19NO3
SMILES
CC=C(C)C(=O)OCC1=CCN2CCC(O)C12
Molecular Weight1
237.29
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Physical Properties

Property Value Unit Source
log10WS -1.68 Crippen Calculated Property
logPoct/wat 0.871 Crippen Calculated Property
McVol 187.000 ml/mol McGowan Calculated Property
Inp [1795.00; 1840.00]   Show Hide
Inp 1797.00 NIST
Inp 1797.00 NIST
Inp 1797.00 NIST
Inp Outlier 1840.00 NIST
Inp 1795.00 NIST
Inp 1797.00 NIST

Similar Compounds

9-tigloylheliotridine. 9-tigloylretronecine. 9-Hydroxyisohexenoylretronecine. 9-Senecioylretronecine. 9-Senicioylheliotridine. 9-Isosenecioylretronecine. 9-Hydroxyheptanoylretronecine. [(7R)-7-Hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl hexanoate. Callimorphine. Isocallimorphine. 7,9-Ditigloylheliotridine. 7,9-Ditigloylretronecine. Creatonotine. 7-(Acetoxymethyl)-2,3,5,7a-tetrahydro-1H-pyrrolizin-1-yl tiglate. Heliotrine (7S).

Find more compounds similar to 9-Angeloylretronecine.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.