Pyxipyrrolone B
AlkaPlorer ID: AK049214
Synonym: None
IUPAC Name: (4S,5R,8R,9R)-8-hydroxy-5-[(2E,4E,6E,9R)-9-hydroxy-8-methylundeca-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)CC)C1=C2[C@@H](C)[C@H](O)CC1
InChI: InChI=1S/C28H37NO5/c1-7-20(30)15(2)11-9-8-10-12-16(3)28(6)19-13-14-21(31)17(4)22(19)24-23(25(28)27(33)34)18(5)29-26(24)32/h8-12,15,17,20-21,25,30-31H,5,7,13-14H2,1-4,6H3,(H,29,32)(H,33,34)/b10-8+,11-9+,16-12+/t15?,17-,20+,21+,25-,28+/m0/s1
InChIKey: LYDLCIJXMDSHBW-DLPGASAZSA-N
Reference
Pyxipyrrolones: Structure Elucidation and Biosynthesis of Cytotoxic Myxobacterial Metabolites
PubChem CID: 139583946
LOTUS: LTS0213402
{NPAtlas: NPA003051
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pyxidicoccus sp. | Pyxidicoccus | Myxococcaceae | Myxococcales | Myxococcia | Myxococcota | None | Bacteria |
Properties Information
Molecule Weight: 467.6060000000003
TPSA？: 110.35
MolLogP？: 5.040600000000007
Number of H-Donors: 4
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|