N-{[2-amino-4-(2-amino-1H-imidazol-4-yl)-5-{[(4-bromo-1-methyl-1H-pyrrol-2-yl)formamido]methyl}-4,5,6,7-tetrahydro-1H-1,3-benzodiazol-6-yl]methyl}-4-bromo-1-methyl-1H-pyrrole-2-carboxamide
AlkaPlorer ID: AK385542
Synonym: None
IUPAC Name: N-[[(5R,6S,7S)-2-amino-7-(2-amino-1H-imidazol-5-yl)-6-[[(4-bromo-1-methylpyrrole-2-carbonyl)amino]methyl]-4,5,6,7-tetrahydro-3H-benzimidazol-5-yl]methyl]-4-bromo-1-methylpyrrole-2-carboxamide
Structure
SMILES: CN1C=C(Br)C=C1C(=O)NC[C@@H]1CC2=C(NC(=N)N2)[C@H](C2=CNC(=N)N2)[C@H]1CNC(=O)C1=CC(Br)=CN1C
InChI: InChI=1S/C24H28Br2N10O2/c1-35-9-12(25)4-17(35)21(37)29-6-11-3-15-20(34-24(28)32-15)19(16-8-31-23(27)33-16)14(11)7-30-22(38)18-5-13(26)10-36(18)2/h4-5,8-11,14,19H,3,6-7H2,1-2H3,(H,29,37)(H,30,38)(H3,27,31,33)(H3,28,32,34)/t11-,14-,19-/m0/s1
InChIKey: GCEXTMOWYCJINA-KLRAXDNASA-N
Reference
N-Methylated ageliferins from the sponge Astrosclera willeyana from Pohnpei
PubChem CID: 163188009
LOTUS: LTS0168001
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Astrosclera willeyana | Astrosclera | Astroscleridae | Agelasida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 648.364
TPSA？: 178.92
MolLogP？: 1.9403399999999995
Number of H-Donors: 8
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|