Sequoiamonascin D
AlkaPlorer ID: AK046491
Synonym: None
IUPAC Name: methyl (9aR)-7-(2-hydroxyethyl)-6,9a-dimethyl-3-[(2R)-2-methyloctanoyl]-2,9-dioxofuro[3,2-g]isoquinoline-4-carboxylate
Structure
SMILES: CCCCCC[C@@H](C)C(=O)C1=C2C(C(=O)OC)=C3C=C(C)N(CCO)C=C3C(=O)[C@]2(C)OC1=O
InChI: InChI=1S/C26H33NO7/c1-6-7-8-9-10-15(2)22(29)20-21-19(24(31)33-5)17-13-16(3)27(11-12-28)14-18(17)23(30)26(21,4)34-25(20)32/h13-15,28H,6-12H2,1-5H3/t15-,26-/m1/s1
InChIKey: DUAOHJBNXYSKOY-PVPMGCCUSA-N
Reference
Sequoiamonascins A−D: Novel Anticancer Metabolites Isolated from a Redwood Endophyte
PubChem CID: 10972749
LOTUS: LTS0262945
SuperNatural Ⅲ: SN0075471-01
{NPAtlas: NPA008392
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus parasiticus | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 471.5500000000003
TPSA？: 110.21
MolLogP？: 2.922000000000001
Number of H-Donors: 1
Number of H-Acceptors: 8
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|