Avrainvillamide

Catalog Number	ACM269741971
CAS Number	269741-97-1
Molecular Weight	445.5
InChI	InChI=1S/C26H27N3O4/c1-23(2)10-8-15-17(33-23)7-6-14-16-12-26-18(24(3,4)20(16)29(32)19(14)15)13-25(21(30)27-26)9-5-11-28(25)22(26)31/h6-8,10,12,18H,5,9,11,13H2,1-4H3,(H,27,30)
InChI Key	ALXLLOQTGLPCFG-UHFFFAOYSA-N
Purity	95%+
Complexity	1100
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Exact Mass	445.20015635
Heavy Atom Count	33
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Monoisotopic Mass	445.20015635
PhysicalState	Powder
Rotatable Bond Count	0
Topological Polar Surface Area	87.4 Ų

Custom Q&A

What is the chemical formula for Avrainvillamide?

The chemical formula for Avrainvillamide is C26H27N3O4.

What is the molecular weight of Avrainvillamide?

The molecular weight of Avrainvillamide is 445.51.

What is the predicted density of Avrainvillamide?

The predicted density of Avrainvillamide is 1.42 ± 0.1 g/cm3.

In what form does Avrainvillamide exist?

Avrainvillamide exists in the form of a solid.

What is the predicted pka value of Avrainvillamide?

The predicted pka value of Avrainvillamide is 11.03 ± 0.60.

What is the storage temperature recommended for Avrainvillamide?

The storage temperature recommended for Avrainvillamide is -20°C.

What biological activity does Avrainvillamide exhibit?

Avrainvillamide is a fungal metabolite and monomeric form of stephacidin B that is active against various bacteria and cancer cells.

Which bacteria is Avrainvillamide active against and what are the minimum inhibitory concentrations (MICs)?

Avrainvillamide is active against S. aureus, S. pyogenes, and E. faecalis with MICs of 12.5, 12.5, and 25 μg/ml, respectively.

Which cancer cells does Avrainvillamide inhibit and what are the GI50 values?

Avrainvillamide inhibits the growth of LNCaP, BT-549, T47D, and MALME-3M cancer cells with GI50 values of 0.24, 0.62, 0.21, and 0.41 μM, respectively.

What evidence suggests the rapid conversion of stephacidin B into Avrainvillamide?

Evidence for the rapid conversion of stephacidin B into the electrophilic monomer Avrainvillamide in cell culture was reported in a study published in the Journal of the American Chemical Society.

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