Pyxipyrrolone A
AlkaPlorer ID: AK032794
Synonym: None
IUPAC Name: (4S,5R,8R,9R)-8-hydroxy-5-[(2E,4E,6E,9R)-9-hydroxy-8,10-dimethylundeca-2,4,6-trien-2-yl]-5,9-dimethyl-3-methylidene-1-oxo-6,7,8,9-tetrahydro-4H-benzo[e]isoindole-4-carboxylic acid
Structure
SMILES: C=C1N=C(O)C2=C1[C@@H](C(=O)O)[C@](C)(/C(C)=C/C=C/C=C/C(C)[C@H](O)C(C)C)C1=C2[C@@H](C)[C@H](O)CC1
InChI: InChI=1S/C29H39NO5/c1-15(2)26(32)16(3)11-9-8-10-12-17(4)29(7)20-13-14-21(31)18(5)22(20)24-23(25(29)28(34)35)19(6)30-27(24)33/h8-12,15-16,18,21,25-26,31-32H,6,13-14H2,1-5,7H3,(H,30,33)(H,34,35)/b10-8+,11-9+,17-12+/t16?,18-,21+,25-,26+,29+/m0/s1
InChIKey: XZVXDGKWYMFGNR-JEHWNZESSA-N
Reference
Pyxipyrrolones: Structure Elucidation and Biosynthesis of Cytotoxic Myxobacterial Metabolites
PubChem CID: 139583499
LOTUS: LTS0226446
{NPAtlas: NPA001468
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pyxidicoccus sp. | Pyxidicoccus | Myxococcaceae | Myxococcales | Myxococcia | Myxococcota | None | Bacteria |
Properties Information
Molecule Weight: 481.63300000000027
TPSA？: 110.35
MolLogP？: 5.286600000000007
Number of H-Donors: 4
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|