Pradimicin B
AlkaPlorer ID: AK032615
Synonym: None
IUPAC Name: (2R)-2-[[(5S,6S)-5-[(2S,3R,4S,5R,6R)-3,4-dihydroxy-6-methyl-5-(methylamino)oxan-2-yl]oxy-1,6,9,14-tetrahydroxy-11-methoxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carbonyl]amino]propanoic acid
Structure
SMILES: CN[C@@H]1[C@H](O)[C@@H](O)[C@H](O[C@H]2C3=CC(C)=C(C(O)=N[C@H](C)C(=O)O)C(O)=C3C3=C(O)C4=C(C=C3[C@@H]2O)C(=O)C2=C(O)C=C(OC)C=C2C4=O)O[C@@H]1C
InChI: InChI=1S/C35H36N2O14/c1-10-6-17-22(28(42)19(10)33(46)37-11(2)34(47)48)21-15(27(41)32(17)51-35-31(45)30(44)24(36-4)12(3)50-35)9-16-23(29(21)43)26(40)14-7-13(49-5)8-18(38)20(14)25(16)39/h6-9,11-12,24,27,30-32,35-36,38,41-45H,1-5H3,(H,37,46)(H,47,48)/t11-,12-,24+,27+,30+,31-,32+,35+/m1/s1
InChIKey: DHQWPIXFALDZDJ-LPEZYDJLSA-N
Reference
Pradimicin, a novel class of potent antifungal antibiotics.
PubChem CID: 5464391
CAS: 117704-66-2
LOTUS: LTS0189382
SuperNatural Ⅲ: SN0065995-03
NPASS: NPC171992
{NPAtlas: NPA019816
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Actinomadura hibisca | Actinomadura | Thermomonosporaceae | Streptosporangiales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 708.6730000000002
TPSA？: 265.12999999999994
MolLogP？: 1.4998199999999997
Number of H-Donors: 9
Number of H-Acceptors: 14
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|