Hypaconitine

CAS: 6900-87-4

Ref. TR-H998150

Product Information

• Name: Hypaconitine
• Synonyms: (1α,6α,14α,15α,16β)1,6,16-Trimethoxy-4-(methoxymethyl)-20-methylaconitane-8,13,14,15-tetrol 8-Acetate 14-Benzoate, (16Beta)-8-(Acetyloxy)-13,15-Dihydroxy-1,6,16-Trimethoxy-4-(Methoxymethyl)-20-Methylaconitan-20-Ium-14-Yl Benzoate Bromide, (6Alpha,14Alpha,15Alpha,16Beta)-8-(Acetyloxy)-13,15-Dihydroxy-1,6,16-Trimethoxy-4-(Methoxymethyl)-20-Methylaconitan-14-Yl Benzoate, 2H-12,3,6a-Ethanylylidene-7,9-methanonaphth[2,3-b]azocine, aconitane-8,13,14,15-tetrol deriv., 8-(Acetyloxy)-13,15-Dihydroxy-1,6,16-Trimethoxy-4-(Methoxymethyl)-20-Methylaconitan-14-Yl Benzoate, Aconitane-8,13,14,15-tetrol, 1,6,16-trimethoxy-4-(methoxymethyl)-20-methyl-, 8-acetate 14-benzoate, (1α,6α,14α,15α,16β)-

Description

Applications An Aconitine (A189875) analog. Aconitine alkaloid pharmacokinetic analgesic. A highly poisonous, neurotoxic alkaloid.
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Li, M., et al.: J. Pharm. Biomed. Anal., 53, 1063 (2010), Yan, G., et al.: J. Pharm. Biomed. Anal., 53, 421 (2010),

• Brand: TRC

Chemical properties

• Molecular weight: 615.71
• Formula: C₃₃H₄₅NO₁₀
• Color/Form: Neat
• InChI: InChI=1S/C33H45NO10/c1-17(35)44-33-21-19(14-31(38,28(42-6)26(33)36)27(21)43-29(37)18-10-8-7-9-11-18)32-20(40-4)12-13-30(16-39-3)15-34(2)25(32)22(33)23(41-5)24(30)32/h7-11,19-28,36,38H,12-16H2,1-6H3/t19-,20+,21-,22+,23+,24-,25?,26+,27-,28+,30+,31-,32+,33-/m1/s1
• InChI key: InChIKey=FIDOCHXHMJHKRW-AYMXWXTASA-N
• SMILES: COCC12CCC(OC)C34[C@H](C(C(OC)[C@H]13)[C@@]1(OC(C)=O)C(O)C(OC)[C@@]3(O)C[C@@H]4[C@@H]1C3OC(=O)c1ccccc1)N(C)C2