Chemical Properties of Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, methyl ester, (19«alpha»)- (CAS 509-80-8)

Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, methyl ester, (19«alpha»)-

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InChI
InChI=1S/C21H24N2O4/c1-12-14-10-23-8-7-21(16-5-3-4-6-17(16)22-20(21)25)18(23)9-13(14)15(11-27-12)19(24)26-2/h3-6,11-14,18H,7-10H2,1-2H3,(H,22,25)
InChI Key
JMIAZDVHNCCPDM-UHFFFAOYSA-N
Formula
C21H24N2O4
SMILES
COC(=O)C1=COC(C)C2CN3CCC4(C(=O)Nc5ccccc54)C3CC12
Molecular Weight1
368.43
CAS
509-80-8
Other Names
  • Mitraphylline
  • Ajmalicine oxindole B
  • Mitraphyllin
  • Rubaradinine
  • Rubradinin
  • methyl 19«alpha»-methyl-2-oxoformosanan-16-carboxylate
  • (1'S,3R,4a'S,5a'S,10a'R)-Methyl 1'-methyl-2-oxo-1',4a',5',5a',7',8',10',10a'-octahydrospiro[indoline-3,6'-pyrano[3,4-f]indolizine]-4'-carboxylate
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Physical Properties

Property Value Unit Source
log10WS -2.94 Crippen Calculated Property
logPoct/wat 2.062 Crippen Calculated Property
McVol 270.090 ml/mol McGowan Calculated Property
Inp [3115.30; 3115.30]   Show Hide
Inp 3115.30 NIST
Inp 3115.30 NIST

Similar Compounds

(1'S,3R,4a'S,5a'S,10a'S)-Methyl 1'-methyl-2-oxo-1',4a',5',5a',7',8',10',10a'-octahydrospiro[indoline-3,6'-pyrano[3,4-f]indolizine]-4'-carboxylate. Nalmefene, trimethylsilyl ether. 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.

Find more compounds similar to Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, methyl ester, (19«alpha»)-.

Sources

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