Mariline A2
AlkaPlorer ID: AK016862
Synonym: None
IUPAC Name: (3S)-5-[(2E)-3,7-dimethylocta-2,6-dienoxy]-7-methoxy-2-[4-methoxy-2-(3-methylbut-2-enoxy)phenyl]-3,6-dimethyl-3H-isoindol-1-one
Structure
SMILES: COC1=CC=C(N2C(=O)C3=C(OC)C(C)=C(OC/C=C(\C)CCC=C(C)C)C=C3[C@@H]2C)C(OCC=C(C)C)=C1
InChI: InChI=1S/C33H43NO5/c1-21(2)11-10-12-23(5)16-18-38-29-20-27-25(7)34(33(35)31(27)32(37-9)24(29)6)28-14-13-26(36-8)19-30(28)39-17-15-22(3)4/h11,13-16,19-20,25H,10,12,17-18H2,1-9H3/b23-16+/t25-/m0/s1
InChIKey: HKXBQPCKPGEUKH-ZMIGGIFCSA-N
Reference
Marilines A–C: Novel Phthalimidines from the Sponge‐Derived Fungus <i>Stachylidium</i> sp.
PubChem CID: 60166663
LOTUS: LTS0169593
{NPAtlas: NPA003711
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Stachylidium | Plectosphaerellaceae | Glomerellales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 533.7090000000004
TPSA？: 57.23
MolLogP？: 8.150120000000006
Number of H-Donors: 0
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|