Szechenyine

Catalog Number	ACM96562888
CAS Number	96562-88-8
Synonyms	8-O-Ethylaconine 3-acetate 14-benzoate
IUPAC Name	Aconitane-3,13,14,15-tetrol, 8-ethoxy-20-ethyl-1,6,16-trimethoxy-4-(me...
Molecular Weight	673.8
Molecular Formula	C36H51NO11
InChI	InChI=1S/C36H51NO11/c1-8-37-17-33(18-42-4)22(47-19(3)38)15-23(43-5)35-21-16-34(41)30(48-32(40)20-13-11-10-12-14-20)24(21)36(46-9-2,29(39)31(34)45-7)25(28(35)37)26(44-6)27(33)35/h10-14,21-31,39,41H,8-9,15-18H2,1-7H3/t21-,22-,23,24,25,26,27,28,29+,30,31+,33+,34-,35,36-/m1/s1
InChI Key	DXAQZKJLRXMIFW-HYCPVBSDSA-N
Boiling Point	711.0±60.0 °C (760 mmHg)
Purity	95%+
Density	1.32±0.1 g/cm³ (20 °C, 760 mmHg)
Complexity	1250
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	7
Exact Mass	673.34621144
Heavy Atom Count	48
Hydrogen Bond Acceptor Count	12
Hydrogen Bond Donor Count	2
Isomeric SMILES	CCN1C[C@@]2([C@@H](CC(C34C2C(C(C31)[C@]5([C@H]([C@@H]([C@]6(C[C@@H]4C5C6OC(=O)C7=CC=CC=C7)O)OC)O)OCC)OC)OC)OC(=O)C)COC
Monoisotopic Mass	673.34621144
PhysicalState	Powder
Rotatable Bond Count	13
Topological Polar Surface Area	142 Ų

Custom Q&A

What is Szechenyine commonly used for in traditional Chinese medicines?

Szechenyine is used in traditional Chinese medicines as a non-diterpinoid alkaloid.

What kind of activity does Szechenyine display?

Szechenyine displays cytotoxic activity.

How is Szechenyine classified in terms of its chemical structure?

Szechenyine is classified as a non-diterpinoid alkaloid.

In what form is Szechenyine typically found in traditional Chinese medicines?

Szechenyine is found in traditional Chinese medicines as a non-diterpinoid alkaloid.

What is a common use of Szechenyine in the field of medicine?

Szechenyine is commonly used for its cytotoxic activity.

Is Szechenyine a natural compound or a synthetic compound?

Szechenyine is a natural compound.

How is Szechenyine typically extracted for use in traditional Chinese medicines?

Szechenyine is typically extracted from natural sources for use in traditional Chinese medicines.

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