Paulomenol B
AlkaPlorer ID: AK023570
Synonym: None
IUPAC Name: (3S,4S)-3-[(2R,3R,4R,5S,6S)-6-(acetyloxymethyl)-3,5-dihydroxy-4-[(2R,4R,5R,6R)-5-hydroxy-4-methoxy-6-methyl-5-[(1R)-1-(2-methylpropanoyloxy)ethyl]oxan-2-yl]oxyoxan-2-yl]-2,4-dihydroxy-6-imino-5-oxocyclohexene-1-carboxylic acid
Structure
SMILES: CO[C@@H]1C[C@H](O[C@H]2[C@@H](O)[C@H](COC(C)=O)O[C@H]([C@H]3C(O)=C(C(=O)O)C(=N)C(=O)[C@H]3O)[C@H]2O)O[C@H](C)[C@@]1(O)[C@@H](C)OC(=O)C(C)C
InChI: InChI=1S/C28H41NO16/c1-9(2)27(38)43-11(4)28(39)10(3)42-15(7-14(28)40-6)45-25-19(31)13(8-41-12(5)30)44-24(23(25)35)17-20(32)16(26(36)37)18(29)22(34)21(17)33/h9-11,13-15,17,19,21,23-25,29,31-33,35,39H,7-8H2,1-6H3,(H,36,37)/t10-,11-,13+,14-,15+,17+,19+,21+,23-,24-,25+,28-/m1/s1
InChIKey: IYCUDHZLMCVJNG-DURKXJPBSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces albus | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 647.6270000000002
TPSA？: 268.89
MolLogP？: -1.6311299999999924
Number of H-Donors: 7
Number of H-Acceptors: 16
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|