Delftibactin A
AlkaPlorer ID: AK326371
Synonym: None
IUPAC Name: 3-[(4-amino-3-hydroxy-2-methylpentanoyl)amino]-4-[[1-[[2-[[(Z)-1-[[1-[[1-[[5-(diaminomethylideneamino)-1-[(1-hydroxy-2-oxopiperidin-3-yl)amino]-1-oxopentan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-5-[formyl(hydroxy)amino]-1-oxopentan-2-yl]amino]-1-oxobut-2-en-2-yl]amino]-2-oxoethyl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-2-hydroxy-4-oxobutanoic acid
Structure
SMILES: C/C=C(\N=C(O)CN=C(O)C(N=C(O)C(N=C(O)C(C)C(O)C(C)N)C(O)C(=O)O)C(C)O)C(O)=NC(CCCN(O)C=O)C(O)=NC(CO)C(O)=NC(CCCNC(=N)N)C(O)=NC1CCCN(O)C1=O
InChI: InChI=1S/C40H68N14O18/c1-5-21(46-26(58)15-45-36(66)27(20(4)57)51-37(67)28(30(60)39(69)70)52-31(61)18(2)29(59)19(3)41)32(62)47-23(10-7-13-53(71)17-56)34(64)50-25(16-55)35(65)48-22(9-6-12-44-40(42)43)33(63)49-24-11-8-14-54(72)38(24)68/h5,17-20,22-25,27-30,55,57,59-60,71-72H,6-16,41H2,1-4H3,(H,45,66)(H,46,58)(H,47,62)(H,48,65)(H,49,63)(H,50,64)(H,51,67)(H,52,61)(H,69,70)(H4,42,43,44)/b21-5-
InChIKey: GCNNBBXYZHJYOR-SQFVCTCFSA-N
Reference
Gold biomineralization by a metallophore from a gold-associated microbe
PubChem CID: 70680458
LOTUS: LTS0207047
{NPAtlas: NPA020191
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Delftia acidovorans | Delftia | Comamonadaceae | Burkholderiales | Betaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 1033.0639999999994
TPSA？: 547.9400000000002
MolLogP？: -2.1807300000000005
Number of H-Donors: 19
Number of H-Acceptors: 19
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|