Palinurine A; 2-Deoxo, 5-oxo
AlkaPlorer ID: AK078807
Synonym: Palinurine B
IUPAC Name: 1-(2-hydroxyethyl)-3-[13-(3-hydroxy-4-methyl-5-oxo-2H-furan-2-yl)-4,8,12-trimethyltrideca-4,6,11-trienyl]-2H-pyrrol-5-one
Structure
SMILES: CC(=CC=CC(C)CCC=C(C)CC1OC(=O)C(C)=C1O)CCCC1=CC(=O)N(CCO)C1
InChI: InChI=1S/C27H39NO5/c1-19(10-6-12-21(3)16-24-26(31)22(4)27(32)33-24)8-5-9-20(2)11-7-13-23-17-25(30)28(18-23)14-15-29/h5,8-9,12,17,19,24,29,31H,6-7,10-11,13-16,18H2,1-4H3
InChIKey: FAEZIVZIULRXKC-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Cunninghamella sp. | Cunninghamella | Cunninghamellaceae | Mucorales | Mucoromycetes | Mucoromycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 457.6110000000004
TPSA？: 87.07000000000001
MolLogP？: 4.930200000000005
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|