Ochrobactin C; N-Deacyl, N-(2E-octenoyl)
AlkaPlorer ID: AK308365
Synonym: Ochrobactin A
IUPAC Name: 2-[2-[[1-carboxy-5-[[(E)-dec-2-enoyl]-hydroxyamino]pentyl]amino]-2-oxoethyl]-4-[[1-carboxy-5-[hydroxy-[(E)-oct-2-enoyl]amino]pentyl]amino]-2-hydroxy-4-oxobutanoic acid
Structure
SMILES: CCCCC/C=C/C(=O)N(O)CCCCC(N=C(O)CC(O)(CC(O)=NC(CCCCN(O)C(=O)/C=C/CCCCCCC)C(=O)O)C(=O)O)C(=O)O
InChI: InChI=1S/C36H60N4O13/c1-3-5-7-9-10-12-14-22-32(44)40(53)24-18-16-20-28(34(47)48)38-30(42)26-36(51,35(49)50)25-29(41)37-27(33(45)46)19-15-17-23-39(52)31(43)21-13-11-8-6-4-2/h13-14,21-22,27-28,51-53H,3-12,15-20,23-26H2,1-2H3,(H,37,41)(H,38,42)(H,45,46)(H,47,48)(H,49,50)/b21-13+,22-14+
InChIKey: DZQMGSXAKUPXFS-JFMUQQRKSA-N
Reference
Structure and membrane affinity of new amphiphilic siderophores produced by Ochrobactrum sp. SP18
PubChem CID: 146684498
CAS: 906064-16-2
LOTUS: LTS0157489
{NPAtlas: NPA028324
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ochrobactrum sp. SP18 | Ochrobactrum | Brucellaceae | Hyphomicrobiales | Alphaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 756.8910000000001
TPSA？: 278.39
MolLogP？: 5.231100000000004
Number of H-Donors: 8
Number of H-Acceptors: 10
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|