Ansatrienin B; N-Deacyl, N-(3-methylbutanoyl)
AlkaPlorer ID: AK288085
Synonym: None
IUPAC Name: (15,22,24-trihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl) 2-(3-methylbutanoylamino)propanoate
Structure
SMILES: COC1C=CC=CC=CCC(OC(=O)C(C)NC(=O)CC(C)C)C(C)C(O)C(C)=CCCC2=C(O)C(=CC(O)=C2)NC(=O)C1
InChI: InChI=1S/C34H48N2O8/c1-21(2)17-30(38)35-24(5)34(42)44-29-16-11-9-7-8-10-15-27(43-6)20-31(39)36-28-19-26(37)18-25(33(28)41)14-12-13-22(3)32(40)23(29)4/h7-11,13,15,18-19,21,23-24,27,29,32,37,40-41H,12,14,16-17,20H2,1-6H3,(H,35,38)(H,36,39)
InChIKey: HUUPADRNVAFGEB-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces seoulensis | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 612.7640000000004
TPSA？: 154.42
MolLogP？: 4.852200000000006
Number of H-Donors: 5
Number of H-Acceptors: 8
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|