Penilumamide B; S,S-Dioxide
AlkaPlorer ID: AK309600
Synonym: Penilumamide C
IUPAC Name: methyl 2-[[2-[(1,3-dimethyl-2,4-dioxopteridine-6-carbonyl)amino]-4-methylsulfonylbutanoyl]amino]benzoate
Structure
SMILES: COC(=O)C1=CC=CC=C1N=C(O)C(CCS(C)(=O)=O)N=C(O)C1=CN=C2C(=N1)C(=O)N(C)C(=O)N2C
InChI: InChI=1S/C22H24N6O8S/c1-27-17-16(20(31)28(2)22(27)33)24-15(11-23-17)19(30)26-14(9-10-37(4,34)35)18(29)25-13-8-6-5-7-12(13)21(32)36-3/h5-8,11,14H,9-10H2,1-4H3,(H,25,29)(H,26,30)
InChIKey: RJLPKFRRHLDCSV-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus sp. | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 532.5350000000002
TPSA？: 195.4
MolLogP？: 0.2099000000000013
Number of H-Donors: 2
Number of H-Acceptors: 12
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|