Sperabillin A
AlkaPlorer ID: AK023188
Synonym: 'Sperabillin A', 'Sperabillin C', 'Antibiotic TAN 749A', 'Antibiotic TAN 749C'
IUPAC Name: (3R,5R)-3-amino-N-(3-amino-3-iminopropyl)-6-[[(2E,4E)-hexa-2,4-dienoyl]amino]-5-hydroxyhexanamide
Structure
SMILES: C/C=C/C=C/C(O)=NC[C@H](O)C[C@@H](N)CC(O)=NCCC(=N)N
InChI: InChI=1S/C15H27N5O3/c1-2-3-4-5-14(22)20-10-12(21)8-11(16)9-15(23)19-7-6-13(17)18/h2-5,11-12,21H,6-10,16H2,1H3,(H3,17,18)(H,19,23)(H,20,22)/b3-2+,5-4+/t11-,12-/m1/s1
InChIKey: OAXPQNCOMDEHMJ-IFCBYPGCSA-N
Reference
Structures of New Pseudo-Peptide Antibiotics, Sperabillins
PubChem CID: 6444138
CAS: 111337-84-9
LOTUS: LTS0263277
SuperNatural Ⅲ: SN0260487-02
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pseudomonas fluorescens | Pseudomonas | Pseudomonadaceae | Pseudomonadales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 325.4130000000001
TPSA？: 161.3
MolLogP？: 0.8261700000000016
Number of H-Donors: 6
Number of H-Acceptors: 5
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|