Chemical Properties of cyclomegistine

cyclomegistine

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InChI
InChI=1S/C18H21NO7/c1-19-11-9-7-6-8-10(11)13(20)12-14(19)18(26-5,16(22)24-3)17(12,25-4)15(21)23-2/h6-9,12,14H,1-5H3/t12?,14?,17-,18+/m1/s1
InChI Key
KNMICIOSHLUGSP-VQHUDLGKSA-N
Formula
C18H21NO7
SMILES
COC(=O)C1(OC)C2C(=O)c3ccccc3N(C)C2C1(OC)C(=O)OC
Molecular Weight1
363.36

Physical Properties

Property Value Unit Source
log10WS -1.17 Crippen Calculated Property
logPoct/wat 0.434 Crippen Calculated Property
McVol 257.170 ml/mol McGowan Calculated Property
Inp 2736.00 NIST

Similar Compounds

Nalmefene. 3-O,6-O,N-Triacetylnormorphine. Benzylmorphine. Nicocodine. Buprenorphine. Dihydroergokryptine. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine. Ergocristine.

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