Oxoepistephamiersine

• CAS: 51804-68-3
• Catalog Number: ACM51804683
• Category: Other Products
• Molecular Weight: 403.4
• Molecular Formula: C₂₁H₂₅NO₇
• Synonyms: 3,4,7,8-Tetramethoxy-12-methyl-7,8,9,10-tetrahydro-8a,4b-(epiminoethano)-8,10-epoxyphenanthrene-6,13(5H)-dione
• InChI: InChI=1S/C21H25NO7/c1-22-15(24)10-19-8-12(23)18(27-4)21(28-5)20(19,22)9-14(29-21)11-6-7-13(25-2)17(26-3)16(11)19/h6-7,14,18H,8-10H2,1-5H3/t14-,18+,19,20+,21/m1/s1
• InChI Key: UMLCCHVXIGOAFZ-BXPSQMFMSA-N
• Density: 5mg 10mg 20 mg
• Complexity: 745
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 3
• Exact Mass: 403.16310214
• Heavy Atom Count: 29
• Hydrogen Bond Acceptor Count: 7
• Hydrogen Bond Donor Count: 0
• Isomeric SMILES: CN1C(=O)CC23[C@]14C[C@H](C5=C2C(=C(C=C5)OC)OC)OC4([C@H](C(=O)C3)OC)OC
• Monoisotopic Mass: 403.16310214
• Physical Description: Powder
• Physical State: Powder
• Rotatable Bond Count: 4
• Topological Polar Surface Area: 83.5 Ų

Custom Q&A

What is the product name of the chemical compound with CAS number 51804-68-3?

Oxoepistephamiersine

What are the synonyms of Oxoepistephamiersine?

Hasubanan-6,16-dione, 8,10-epoxy-3,4,7,8-tetramethoxy-17-methyl-, (7β,8β,10β)- and 3,4,7,8-tetramethoxy-12-methyl-7,8,9,10-tetrahydro-8a,4b-(epiminoethano)-8,10-epoxyphenanthrene-6,13(5H)-dione

What is the molecular formula of Oxoepistephamiersine?

C21H25NO7

What is the molar mass of Oxoepistephamiersine?

403.43 g/mol

What is the predicted boiling point of Oxoepistephamiersine?

603.9±55.0 °C

In what solvents is Oxoepistephamiersine soluble?

Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

What is the physical form of Oxoepistephamiersine?

Powder

What is the predicted pKa value of Oxoepistephamiersine?

-2.46±0.60

Can Oxoepistephamiersine be dissolved in water?

No, it is not listed as one of the solvents in which it is soluble.

How many methyl groups are present in the molecular structure of Oxoepistephamiersine?

5 methyl groups