Molecule

Diaporisoindole A

AlkaPlorer ID: AK109773

Synonym: None

IUPAC Name: (3S)-7-hydroxy-3-[(3S)-3-(2-hydroxypropan-2-yl)-7-methyl-2,3-dihydro-1,4-benzodioxin-5-yl]-4-(3-methylbut-2-enyl)-2,3-dihydroisoindol-1-one

Structure

SMILES: CC(C)=CCC1=CC=C(O)C2=C1[C@@H](C1=CC(C)=CC3=C1O[C@H](C(C)(C)O)CO3)N=C2O

InChI: InChI=1S/C25H29NO5/c1-13(2)6-7-15-8-9-17(27)21-20(15)22(26-24(21)28)16-10-14(3)11-18-23(16)31-19(12-30-18)25(4,5)29/h6,8-11,19,22,27,29H,7,12H2,1-5H3,(H,26,28)/t19-,22+/m0/s1

InChIKey: FMZQVUPZAJIUSS-SIKLNZKXSA-N

Reference

Diaporisoindoles A–C: Three Isoprenylisoindole Alkaloid Derivatives from the Mangrove Endophytic Fungus <i>Diaporthe</i> sp. SYSU-HQ3

PubChem CID: 139051042

LOTUS: LTS0174231

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NPAtlas: NPA023877

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Diaporthe sp.	Diaporthe	Diaporthaceae	Diaporthales	Sordariomycetes	Ascomycota	Fungi	Eukaryota

Properties Information

Molecule Weight: 423.5090000000002

TPSA？: 91.51

MolLogP？: 4.527620000000003

Number of H-Donors: 3

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi