(4R,4aS,12aS)-2-acetyl-4-amino-3,10,11,12a-tetrahydroxy-6,9-dimethyl-4a,5-dihydro-4H-tetracene-1,12-dione
AlkaPlorer ID: AK012449
Synonym: None
IUPAC Name: (1R,4aR,12aS)-3-acetyl-1-amino-4,4a,6,7-tetrahydroxy-8,11-dimethyl-12,12a-dihydro-1H-tetracene-2,5-dione
Structure
SMILES: CC(=O)C1=C(O)[C@H](N)[C@@H]2CC3=C(C)C4=CC=C(C)C(O)=C4C(O)=C3C(=O)[C@]2(O)C1=O
InChI: InChI=1S/C22H21NO7/c1-7-4-5-10-8(2)11-6-12-16(23)19(27)13(9(3)24)20(28)22(12,30)21(29)15(11)18(26)14(10)17(7)25/h4-5,12,16,25-27,30H,6,23H2,1-3H3/t12-,16+,22+/m0/s1
InChIKey: IRCLZBUBOWPFCH-ONJZCGHCSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Amycolatopsis sulphurea | Amycolatopsis | Pseudonocardiaceae | Pseudonocardiales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 411.4100000000002
TPSA？: 158.14999999999998
MolLogP？: 1.2650399999999995
Number of H-Donors: 5
Number of H-Acceptors: 8
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|