Compound Q&A

What are the physical and chemical properties of (4S,4aR,5S,5aR,6R,12aS)-4-(Dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydro-2-tetracenecarboxamide hydrate (CAS: 17086-28-1)?

Answer

(4S,4aR,5S,5aR,6R,12aS)-4-(Dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydro-2-tetracenecarboxamide hydrate (1:1)
This compound is a hydrate with a molecular weight of approximately 700 g/mol. It crystallizes as a hydrate with a 1:1 ratio. The compound has low solubility in water but is soluble in organic solvents such as ethanol and methanol. It is moderately reactive with nucleophiles and can undergo hydrolysis. It is known for its stability under normal conditions but should be stored in a dry environment to prevent degradation.

About

CAS No 17086-28-1
English Name (4S,4aR,5S,5aR,6R,12aS)-4-(Dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydro-2-tetracenecarboxamide hydrate (1:1)
Molecular Formula C22H26N2O9
Molecular Weight 462.46 g/mol
SMILES CC1C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.O
InChIKey XQTWDDCIUJNLTR-CVHRZJFOSA-N
Last Updated: 2025-10-01 21:42

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