N-[4-(4-Hydroxybenzoylamino)butyl]-1,3-dimethyllumazine-6-carboxamide; Homologue (n = 5)
AlkaPlorer ID: AK135545
Synonym: N-[5-(4-Hydroxybenzoylamino)pentyl]-1,3-dimethyllumazine-6-carboxamide
IUPAC Name: N-[5-[(4-hydroxybenzoyl)amino]pentyl]-1,3-dimethyl-2,4-dioxopteridine-6-carboxamide
Structure
SMILES: CN1C(=O)C2=NC(C(O)=NCCCCCNC(=O)C3=CC=C(O)C=C3)=CN=C2N(C)C1=O
InChI: InChI=1S/C21H24N6O5/c1-26-17-16(20(31)27(2)21(26)32)25-15(12-24-17)19(30)23-11-5-3-4-10-22-18(29)13-6-8-14(28)9-7-13/h6-9,12,28H,3-5,10-11H2,1-2H3,(H,22,29)(H,23,30)
InChIKey: DMBMHTJPCOXOJP-UHFFFAOYSA-N
Reference
1,3-Dimethyllumazine Derivatives from <i>Limnatis </i><i>n</i><i>ilotica</i>
PubChem CID: 11430595
LOTUS: LTS0020265
SuperNatural Ⅲ: SN0069375
COCONUT: CNP0383806
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Limnatis nilotica | Limnatis | Hirudinidae | Hirudinida | Clitellata | Annelida | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 440.4600000000001
TPSA？: 151.70000000000002
MolLogP？: 0.6376999999999985
Number of H-Donors: 3
Number of H-Acceptors: 9
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|