Chemical Properties of Isoipanguline B1

Isoipanguline B1

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InChI
InChI=1S/C20H27NO7/c1-12(22)20(2,26)19(25)27-11-13-7-9-21-10-8-16(17(13)21)28-18(24)14-5-3-4-6-15(14)23/h3-6,12-13,16-17,22-23,26H,7-11H2,1-2H3/t12-,13-,16-,17?,20+/m0/s1
InChI Key
HQNBAGWQDKKAMY-HHFZGZQUSA-N
Formula
C20H27NO7
SMILES
CC(O)C(C)(O)C(=O)OCC1CCN2CCC(OC(=O)c3ccccc3O)C12
Molecular Weight1
393.43
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Physical Properties

Property Value Unit Source
log10WS -2.24 Crippen Calculated Property
logPoct/wat 0.687 Crippen Calculated Property
McVol 289.650 ml/mol McGowan Calculated Property
Inp [2770.00; 2770.00]   Show Hide
Inp 2770.00 NIST
Inp 2770.00 NIST

Similar Compounds

Ipanguline B1. Ipanguline B2. Isoipanguline B2. Ipanguline B3. Baptifoline. Epibaptifoline. Argentamin. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. Codeine-propionyl. Ajmaline. Galantamin. Brucine. TCN. QUINIDINE, M(HO-), AC. 9H-Purine, 9-[2-deoxy-3-O-(trimethylsilyl)-«beta»-D-erythro-pentofuranosyl]-6-(trimethylsiloxy)-2-[(trimethylsilyl)amino]-, 5'-[bis(trimethylsilyl) phospate].

Find more compounds similar to Isoipanguline B1.

Sources

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