Totopotensamide B; 11''-O-(4-O-Methyl-β-D-glucopyranoside)
AlkaPlorer ID: AK316186
Synonym: Totopotensamide A
IUPAC Name: N-[1-[[1-[[5-butan-2-yl-2-(2-chloro-3,5-dihydroxy-4-methylphenyl)-11-methyl-3,6,9,13-tetraoxo-1,4,7,10-tetrazacyclotridec-12-yl]amino]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]-11-[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-9,12-dihydroxy-4,6,8,10-tetramethyl-3-oxotridecanamide
Structure
SMILES: CCC(C)C1N=C(O)C(C2=CC(O)=C(C)C(O)=C2Cl)N=C(O)C(N=C(O)C(C)N=C(O)C(N=C(O)CC(=O)C(C)CC(C)CC(C)C(O)C(C)C(OC2OC(CO)C(OC)C(O)C2O)C(C)O)C(C)O)C(C)N=C(O)CN=C1O
InChI: InChI=1S/C52H84ClN7O19/c1-13-21(3)37-48(73)54-18-35(67)55-26(8)38(49(74)60-40(51(76)58-37)30-16-32(65)24(6)42(69)36(30)53)59-47(72)27(9)56-50(75)39(28(10)62)57-34(66)17-31(64)22(4)14-20(2)15-23(5)41(68)25(7)45(29(11)63)79-52-44(71)43(70)46(77-12)33(19-61)78-52/h16,20-23,25-29,33,37-41,43-46,52,61-63,65,68-71H,13-15,17-19H2,1-12H3,(H,54,73)(H,55,67)(H,56,75)(H,57,66)(H,58,76)(H,59,72)(H,60,74)
InChIKey: VQJONPIPGATABZ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces pactum | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
| Streptomyces sp. 1053U.I.1a.1b | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 1146.7270000000003
TPSA？: 434.7300000000001
MolLogP？: 3.984220000000007
Number of H-Donors: 15
Number of H-Acceptors: 19
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|