Chemical Properties of Isoipanguline A1

Isoipanguline A1

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InChI
InChI=1S/C21H29NO6/c1-14(23)21(2,26)20(25)27-13-16-8-10-22-11-9-17(19(16)22)28-18(24)12-15-6-4-3-5-7-15/h3-7,14,16-17,19,23,26H,8-13H2,1-2H3/t14-,16-,17-,19?,21+/m0/s1
InChI Key
ZIZWTEQHLVZFMT-ANOOSVGQSA-N
Formula
C21H29NO6
SMILES
CC(O)C(C)(O)C(=O)OCC1CCN2CCC(OC(=O)Cc3ccccc3)C12
Molecular Weight1
391.46
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Physical Properties

Property Value Unit Source
log10WS -2.53 Crippen Calculated Property
logPoct/wat 0.910 Crippen Calculated Property
McVol 297.870 ml/mol McGowan Calculated Property
Inp [2702.00; 2702.00]   Show Hide
Inp 2702.00 NIST
Inp 2702.00 NIST
Inp 2702.00 NIST

Similar Compounds

Ipanguline A1. Ipanguline A4. Ipanguline A2. Isoipanguline A2. Ipanguline A3. Isoipanguline A3. Ipanguline C7. Ipanguline C6. Ipanguline D6. Ipanguline B1. Isoipanguline B1. Ipanguline D13. Ipanguline D16. 6-(2-Methylbutyryloxy)-hyoscyamine. 6-Tigloyloxyhyoscyamine.

Find more compounds similar to Isoipanguline A1.

Sources

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