Compound Q&A

What are the physical and chemical properties of 4-Methylaconitane-1,3,6,8,13,14,16,18-octol (CAS: 80787-51-5)?

Answer

4-Methylaconitane-1,3,6,8,13,14,16,18-octol; (1α,3α,6α,14α,16β)-form, O1,O6,O16,O18-Tetra-Me, N-Et, 14-O-(4-methoxybenzoyl), 3,8-di-Ac
4-Methylaconitane-1,3,6,8,13,14,16,18-octol (CAS: 80787-51-5) is a crystalline compound with a molecular weight of approximately 824.93 g/mol. It has a low solubility in water but is more soluble in organic solvents such as ethanol and acetone. This compound exhibits some reactivity towards nucleophiles and electrophiles, typical of its chemical structure. It is important to handle it under appropriate conditions to avoid unwanted reactions.

About

CAS No 80787-51-5
English Name 4-Methylaconitane-1,3,6,8,13,14,16,18-octol; (1α,3α,6α,14α,16β)-form, O1,O6,O16,O18-Tetra-Me, N-Et, 14-O-(4-methoxybenzoyl), 3,8-di-Ac
Molecular Formula C37H51NO12
Molecular Weight 701.800352334976 g/mol
SMILES CCN1CC2(COC)C3C(OC)C4C1C3(C1CC3(O)C(OC(=O)c5ccc(OC)cc5)C1C4(CC3OC)OC(C)=O)C(CC2OC(C)=O)OC
InChIKey QXHJUYOYZPRGCF-UHFFFAOYSA-N
Last Updated: 2026-04-01 03:49

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