benzoylaconine structure, CAS 466-24-0

benzoylaconine

CAS Number466-24-0

SynonymsPikraconitin; Picraconitine; enzoylaconitine; 8-O-deacetylaconitine; Isaconitine; 14-O-Benzoylaconine; benzoylaconine; Benzoylaconitine; Aconine 14-benzoate

Molecular FormulaC32H45NO10

Molecular Weight603.700

Purity98%%

Density1.4±0.1 g/cm3

Boiling Point711.4±60.0 °C at 760 mmHg

Melting Point130°C

Flash Point

Appearance

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Cat. No.: 2A-1169389 Purity: 98%%
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Quality Control of [ 466-24-0 ] Purity: 98%% SDS Specification MoL

Chemical & Physical Properties
CAS Number466-24-0
Catalog No.2A-1169389
Chinese Name苯甲酰乌头原碱
SynonymsPikraconitin; Picraconitine; enzoylaconitine; 8-O-deacetylaconitine; Isaconitine; 14-O-Benzoylaconine; benzoylaconine; Benzoylaconitine; Aconine 14-benzoate
Molecular FormulaC32H45NO10
Molecular Weight603.700
Purity98%
Density1.4±0.1 g/cm3
Boiling Point711.4±60.0 °C at 760 mmHg
Melting Point130°C
ApplicationBenzoylaconine (Isaconitine; Pikraconitin) is aconite alkaloid in traditional Chinese medicine.
PubChem ID135076963
SMILESCCN1CC2(COC)C(O)CC(OC)C34C5CC6(O)C(OC)C(O)C(O)(C5C6OC(=O)c5ccccc5)C(C(OC)C23)C14
InChIInChI=1S/C32H45NO10/c1-6-33-14-29(15-39-2)18(34)12-19(40-3)31-17-13-30(37)26(43-28(36)16-10-8-7-9-11-16)20(17)32(38,25(35)27(30)42-5)21(24(31)33)22(41-4)23(29)31/h7-11,17-27,34-35,37-38H,6,12-15H2,1-5H3/t17-,18-,19+,20-,21+,22+,23-,24-,25+,26-,27+,29+,30-,31+,32-/m1/s1
InChI KeyDHJXZSFKLJCHLH-BMTFSNIDSA-N
Transport InfoProduct Name: Benzoylaconitine
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