Structure

Cycleanine

CAS
518-94-5
Catalog Number
ACM518945
Category
Other Products
Molecular Weight
622.7
Molecular Formula
C38H42N2O6

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Specification

Synonyms
7,7'-O,O-Dimethylisochondodendrine
InChI
InChI=1S/C38H42N2O6/c1-39-17-15-25-21-31(41-3)35(43-5)37-33(25)29(39)19-23-7-11-28(12-8-23)46-38-34-26(22-32(42-4)36(38)44-6)16-18-40(2)30(34)20-24-9-13-27(45-37)14-10-24/h7-14,21-22,29-30H,15-20H2,1-6H3/t29-,30-/m1/s1
InChI Key
ANOXEUSGZWSCQL-LOYHVIPDSA-N
Density
1.172g/cm³
Complexity
895
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
2
Exact Mass
622.30428706
Heavy Atom Count
46
Hydrogen Bond Acceptor Count
8
Hydrogen Bond Donor Count
0
Isomeric SMILES
CN1CCC2=CC(=C(C3=C2[C@H]1CC4=CC=C(C=C4)OC5=C6[C@@H](CC7=CC=C(O3)C=C7)N(CCC6=CC(=C5OC)OC)C)OC)OC
Monoisotopic Mass
622.30428706
Physical State
Powder
Rotatable Bond Count
4
Topological Polar Surface Area
61.9 Ų
What is the chemical formula for Cycleanine?

The chemical formula for Cycleanine is C38H42N2O6.

What is the molecular weight of Cycleanine?

The molecular weight of Cycleanine is 622.75 g/mol.

What is the melting point of Cycleanine?

The melting point of Cycleanine is 272-273 °C.

In which medicinal plant is Cycleanine obtained from?

Cycleanine is obtained from the Triclisia subcordata Oliv.

What is the in-vitro activity of Cycleanine?

It displays in-vitro anti-ovarian cancer activity.

What is the storage temperature recommended for Cycleanine?

The recommended storage temperature for Cycleanine is 4°C, away from moisture and light.

In which solvents is Cycleanine soluble?

Cycleanine is soluble in Acetone, Dichloromethane, DMSO, and Ethyl Acetate.

What is the predicted boiling point of Cycleanine?

The predicted boiling point of Cycleanine is 691.6±55.0 °C.

What is the predicted pKa of Cycleanine?

The predicted pKa of Cycleanine is 7.56±0.20.

What are some synonyms for Cycleanine?

Some synonyms for Cycleanine include Dimethylisochondodendrine and o,o-Dimethylisochondodendrin.

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