(2S,21S)-21-hydroxy-1-[(5R)-4-hydroxy-5-[(4-hydroxyphenyl)methyl]-2-oxo-1,5-dihydropyrrol-3-yl]-2-methyl-22-{[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}docosane-1,11-dione
AlkaPlorer ID: AK126791
Synonym: None
IUPAC Name: (5R)-3-[(2S,21S)-1,21-dihydroxy-2-methyl-11-oxo-22-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxydocosylidene]-5-[(4-hydroxyphenyl)methyl]pyrrolidine-2,4-dione
Structure
SMILES: C[C@@H](CCCCCCCCC(=O)CCCCCCCCC[C@H](O)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)C(=O)C1=C(O)[C@@H](CC2=CC=C(O)C=C2)N=C1O
InChI: InChI=1S/C40H63NO12/c1-26(34(46)33-35(47)31(41-39(33)51)23-27-19-21-29(44)22-20-27)15-11-7-5-6-9-13-17-28(43)16-12-8-3-2-4-10-14-18-30(45)25-52-40-38(50)37(49)36(48)32(24-42)53-40/h19-22,26,30-32,36-38,40,42,44-45,47-50H,2-18,23-25H2,1H3,(H,41,51)/t26-,30-,31+,32+,36+,37-,38-,40+/m0/s1
InChIKey: WYTYMMOCYHJUDR-OEDDAONGSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Lachnum virgineum | Lachnum | Lachnaceae | Helotiales | Leotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 749.9390000000002
TPSA？: 226.8
MolLogP？: 4.6689000000000025
Number of H-Donors: 8
Number of H-Acceptors: 12
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|