Diaporisoindole C
AlkaPlorer ID: AK109784
Synonym: None
IUPAC Name: 3-[7-hydroxy-3-[(3S)-3-(2-hydroxypropan-2-yl)-7-methyl-2,3-dihydro-1,4-benzodioxin-5-yl]-4-(3-methylbut-2-enyl)isoindol-1-ylidene]-1-[(3S)-3-(2-hydroxypropan-2-yl)-7-methyl-2,3-dihydro-1,4-benzodioxin-5-yl]-7-(3-methylbut-2-enyl)isoindol-4-ol
Structure
SMILES: CC(C)=CCC1=CC=C(O)C2=C1C(C1=CC(C)=CC3=C1O[C@H](C(C)(C)O)CO3)=NC2=C1N=C(C2=CC(C)=CC3=C2O[C@H](C(C)(C)O)CO3)C2=C(CC=C(C)C)C=CC(O)=C12
InChI: InChI=1S/C50H54N2O8/c1-25(2)11-13-29-15-17-33(53)41-39(29)43(31-19-27(5)21-35-47(31)59-37(23-57-35)49(7,8)55)51-45(41)46-42-34(54)18-16-30(14-12-26(3)4)40(42)44(52-46)32-20-28(6)22-36-48(32)60-38(24-58-36)50(9,10)56/h11-12,15-22,37-38,53-56H,13-14,23-24H2,1-10H3/t37-,38-/m0/s1
InChIKey: HDRUNFXHQOQTHT-UWXQCODUSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Diaporthe sp. | Diaporthe | Diaporthaceae | Diaporthales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 810.988
TPSA？: 142.56
MolLogP？: 9.081240000000005
Number of H-Donors: 4
Number of H-Acceptors: 10
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|