13-deoxydaunorubicin
AlkaPlorer ID: AK006821
Synonym: '13-Deoxydaunomycin', '13-Deoxydaunorubicin', 'Feudomycin A'
IUPAC Name: (7R,9R)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-9-ethyl-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
Structure
SMILES: CC[C@@]1(O)CC2=C(O)C3=C(C(=O)C4=C(OC)C=CC=C4C3=O)C(O)=C2[C@H](O[C@H]2C[C@H](N)[C@H](O)[C@H](C)O2)C1
InChI: InChI=1S/C27H31NO9/c1-4-27(34)9-13-19(16(10-27)37-17-8-14(28)22(29)11(2)36-17)26(33)21-20(24(13)31)23(30)12-6-5-7-15(35-3)18(12)25(21)32/h5-7,11,14,16-17,22,29,31,33-34H,4,8-10,28H2,1-3H3/t11-,14-,16+,17-,22+,27+/m0/s1
InChIKey: XAMIMZAWZUSOPA-LCJRXSHZSA-N
Reference
New anthracyclines, feudomycins, produced by the mutant from Streptomyces coeruleorubidus ME130-A4.
PubChem CID: 162892771
LOTUS: LTS0272138
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces coeruleorubidus | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 513.5430000000002
TPSA？: 168.77
MolLogP？: 1.8499
Number of H-Donors: 5
Number of H-Acceptors: 10
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|