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(1alpha,14alpha,16beta)-20-Ethyl-1,16-Dimethoxyaconitane-8,13,14-Triol 14-(4-Methoxybenzoate)
[CAS# 131653-96-8]

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CAS#: 131653-96-8
Product: (1alpha,14alpha,16beta)-20-Ethyl-1,16-Dimethoxyaconitane-8,13,14-Triol 14-(4-Methoxybenzoate)
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Identification
Name (1alpha,14alpha,16beta)-20-Ethyl-1,16-Dimethoxyaconitane-8,13,14-Triol 14-(4-Methoxybenzoate)
Synonyms 1,16-Dimethoxy-20-Ethyl-14-(4-Methoxybenzoyloxy)Aconitan-8,13-Diol Hydrochloride; 20-Ethyl-1,16-Dimethoxyaconitane-8,13,14-Triol 14-(4-Methoxybenzoate), (1Alpha,14Alpha,16Beta)-; Aconitane-8,13,14-Triol, 20-Ethyl-1,16-Dimethoxy-, 14-(4-Methoxybenzoate), (1Alpha,14Alpha,16Bet)-
Molecular Structure CAS#: 131653-96-8, (1alpha,14alpha,16beta)-20-Ethyl-1,16-Dimethoxyaconitane-8,13,14-Triol 14-(4-Methoxybenzoate)
Molecular Formula C30H41NO6
Molecular Weight 511.66
CAS Registry Number 131653-96-8
SMILES C7=C(C(OC2C1C3C46C5CC(C1(CC(C2C3)OC)O)C4N(CC)CC5CCC6OC)=O)C=CC(=C7)OC
InChI 1S/C30H41NO6/c1-5-31-15-17-8-11-24(36-4)30-20(17)13-22(27(30)31)29(33)14-23(35-3)19-12-21(30)25(29)26(19)37-28(32)16-6-9-18(34-2)10-7-16/h6-7,9-10,17,19-27,33H,5,8,11-15H2,1-4H3
InChIKey AVBUZBLOHGCPMP-UHFFFAOYSA-N
Properties
Density 1.282g/cm3 (Cal.)
Boiling point 626.911°C at 760 mmHg (Cal.)
Flash point 332.944°C (Cal.)
Market Analysis Reports
List of Reports Available for (1alpha,14alpha,16beta)-20-Ethyl-1,16-Dimethoxyaconitane-8,13,14-Triol 14-(4-Methoxybenzoate)
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