Asterobactin
AlkaPlorer ID: AK289646
Synonym: None
IUPAC Name: [3-[[1-[1-[[5-[carbamimidoyl(hydroxy)amino]-1-(hydroxyamino)-1-oxopentan-2-yl]amino]-2-methyl-1-oxoundecan-3-yl]oxy-5-[formyl(hydroxy)amino]-1-oxopentan-2-yl]amino]-2-hydroxy-3-oxopropyl] 2-hydroxybenzoate
Structure
SMILES: CCCCCCCCC(OC(=O)C(CCCN(O)C=O)N=C(O)C(O)COC(=O)C1=CC=CC=C1O)C(C)C(O)=NC(CCCN(O)C(=N)N)C(O)=NO
InChI: InChI=1S/C34H55N7O13/c1-3-4-5-6-7-8-17-28(22(2)29(45)37-24(30(46)39-50)14-12-19-41(52)34(35)36)54-33(49)25(15-11-18-40(51)21-42)38-31(47)27(44)20-53-32(48)23-13-9-10-16-26(23)43/h9-10,13,16,21-22,24-25,27-28,43-44,50-52H,3-8,11-12,14-15,17-20H2,1-2H3,(H3,35,36)(H,37,45)(H,38,47)(H,39,46)
InChIKey: ICFNGWYSCWYFGU-UHFFFAOYSA-N
Reference
Asterobactin, a New Siderophore Group Antibiotic from Nocardia asteroides.
PubChem CID: 10010395
CAS: 482372-30-5
LOTUS: LTS0076377
COCONUT: CNP0103637.3
{NPAtlas: NPA000316
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Nocardia asteroides | Nocardia | Nocardiaceae | Mycobacteriales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 769.8499999999999
TPSA？: 324.94
MolLogP？: 3.196970000000003
Number of H-Donors: 10
Number of H-Acceptors: 14
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|