2'-Amino-2,4,5,10'-tetrahydroxy-5'-methoxy-7-methyl-[1,9'-bianthracene]-4',9,10(3'H)-trione
AlkaPlorer ID: AK040646
Synonym: None
IUPAC Name: 1-(2-amino-10-hydroxy-5-methoxy-4-oxo-3H-anthracen-9-yl)-2,4,5-trihydroxy-7-methylanthracene-9,10-dione
Structure
SMILES: COC1=CC=CC2=C1C(O)=C1C(=O)CC(N)=CC1=C2C1=C(O)C=C(O)C2=C1C(=O)C1=CC(C)=CC(O)=C1C2=O
InChI: InChI=1S/C30H21NO8/c1-11-6-15-23(16(32)7-11)30(38)26-19(35)10-18(34)25(27(26)28(15)36)21-13-4-3-5-20(39-2)24(13)29(37)22-14(21)8-12(31)9-17(22)33/h3-8,10,32,34-35,37H,9,31H2,1-2H3
InChIKey: CWCOWNCCNNIIBA-UHFFFAOYSA-N
Reference
Anthraquinone pigment with herbicidal potential from Phoma herbarum FGCC#54
PubChem CID: 54752970
LOTUS: LTS0079127
COCONUT: CNP0131667
{NPAtlas: NPA002080
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Phoma herbarum | Phoma | Didymellaceae | Pleosporales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 523.4970000000003
TPSA？: 167.38
MolLogP？: 4.307620000000004
Number of H-Donors: 5
Number of H-Acceptors: 9
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|