Antibiotic LL-BM 547β
AlkaPlorer ID: AK288520
Synonym: LL-BM 547β
IUPAC Name: N-[(6Z)-3-(2-amino-4-hydroxy-1,4,5,6-tetrahydropyrimidin-6-yl)-6-[(carbamoylamino)methylidene]-9,12-bis(hydroxymethyl)-2,5,8,11,14-pentaoxo-1,4,7,10,13-pentazacyclohexadec-15-yl]-5-(diaminomethylideneamino)-3-(methylamino)pentanamide
Structure
SMILES: CNC(CCNC(=N)N)CC(=O)NC1CNC(=O)C(C2CC(O)NC(=N)N2)NC(=O)/C(=C/NC(N)=O)NC(=O)C(CO)NC(=O)C(CO)NC1=O
InChI: InChI=1S/C26H45N15O10/c1-31-10(2-3-32-24(27)28)4-16(44)35-12-6-33-23(50)18(11-5-17(45)40-25(29)39-11)41-20(47)13(7-34-26(30)51)36-21(48)14(8-42)38-22(49)15(9-43)37-19(12)46/h7,10-12,14-15,17-18,31,42-43,45H,2-6,8-9H2,1H3,(H,33,50)(H,35,44)(H,36,48)(H,37,46)(H,38,49)(H,41,47)(H4,27,28,32)(H3,29,39,40)(H3,30,34,51)/b13-7-
InChIKey: WXHGVZMTCYBKFX-QPEQYQDCSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Nocardia sp. | Nocardia | Nocardiaceae | Mycobacteriales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 727.7410000000001
TPSA？: 412.2499999999999
MolLogP？: -9.278160000000016
Number of H-Donors: 18
Number of H-Acceptors: 13
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|