Antibiotic LL-AB 664
AlkaPlorer ID: AK031243
Synonym: 'Antibiotic LL-AB 664', 'LL-AB 664', 'BD 12'
IUPAC Name: [(2S,3R,4R,5R,6R)-6-[[(3aS,7R,7aS)-7-hydroxy-5-methyl-4-oxo-3a,6,7,7a-tetrahydro-1H-imidazo[4,5-c]pyridin-2-yl]amino]-5-[[2-(aminomethylideneamino)acetyl]-methylamino]-4-hydroxy-2-(hydroxymethyl)oxan-3-yl] carbamate
Structure
SMILES: CN1C[C@@H](O)[C@H]2N=C(N[C@@H]3O[C@@H](CO)[C@H](OC(=N)O)[C@H](O)[C@H]3N(C)C(=O)CNC=N)N[C@@H]2C1=O
InChI: InChI=1S/C18H30N8O8/c1-25-4-7(28)10-11(16(25)31)23-18(22-10)24-15-12(26(2)9(29)3-21-6-19)13(30)14(34-17(20)32)8(5-27)33-15/h6-8,10-15,27-28,30H,3-5H2,1-2H3,(H2,19,21)(H2,20,32)(H2,22,23,24)/t7-,8+,10-,11+,12-,13-,14+,15-/m1/s1
InChIKey: VMULEITVZASJMA-MAPXQVSGSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Simmondsia chinensis | Simmondsia | Simmondsiaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Strychnos pungens | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Carpesium abrotanoides | Carpesium | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 486.48600000000016
TPSA？: 236.15
MolLogP？: -4.914959999999991
Number of H-Donors: 9
Number of H-Acceptors: 12
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|