Chemical Properties of AJMALINE, AC (CAS 19775-56-5)

AJMALINE, AC

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InChI
InChI=1S/C24H30N2O4/c1-5-14-15-10-18-21-24(16-8-6-7-9-17(16)25(21)4)11-19(20(15)22(24)29-12(2)27)26(18)23(14)30-13(3)28/h6-9,14-15,18-23H,5,10-11H2,1-4H3
InChI Key
GSRQQKLTXCUIFV-UHFFFAOYSA-N
Formula
C24H30N2O4
SMILES
CCC1C2CC3C4N(C)c5ccccc5C45CC(C2C5OC(C)=O)N3C1OC(C)=O
Molecular Weight1
410.51
CAS
19775-56-5
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Physical Properties

Property Value Unit Source
log10WS -3.81 Crippen Calculated Property
logPoct/wat 2.696 Crippen Calculated Property
McVol 305.800 ml/mol McGowan Calculated Property
Inp [2890.00; 2890.00]   Show Hide
Inp 2890.00 NIST
Inp 2890.00 NIST

Similar Compounds

Nalmefene. Strychnine. 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.

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Sources

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