157047-98-8
Chemical Structure
Benzomalvin C
- CAS No.: 157047-98-8
- Formula:C24H17N3O3
- Molecular Weight:395.41
IUPAC Name: (3'R,7S)-6-methyl-3'-phenyl-13H-spiro[benzo[6,7][1,4]diazepino[2,1-b]quinazoline-7,2'-oxirane]-5,13(6H)-dione
InChIKey: TWDKBDSVUUKABK-HYBUGGRVSA-N
SMILES: O=C1C2=C(N=C3N1C4=C(C(N([C@]35O[C@@H]5C6=CC=CC=C6)C)=O)C=CC=C4)C=CC=C2
Biological Activity: Benzomalvin C is a weak antagonist of the neurokinin-1 (NK1) receptor inhibiting binding of substance P by 46% when used at 100 μg/mL in vitro. It is also a weak inhibitor of indolamine 2,3-dioxygenase (IDO) with an IC50 value of 130 μM for recombinant IDO. It is isolated from Penicillium and contains an epoxide group at C-19 and C-20, which is not present in benzomalvins A, B, or E.
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Benzomalvin C | Benzomalvin C is a weak antagonist of the neurokinin-1 (NK1) receptor inhibiting binding of substance P by 46% when used at 100 μg/mL in vitro. It is also a weak inhibitor of indolamine 2,3-dioxygenase (IDO) with an IC50 value of 130 μM for recombinant IDO. It is isolated from Penicillium and contains an epoxide group at C-19 and C-20, which is not present in benzomalvins A, B, or E. | |||||||||||||||||||||
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