Apicularen B
AlkaPlorer ID: AK041858
Synonym: 'Apicularene B', 'Not named'
IUPAC Name: (2Z,4Z)-N-[(E)-3-[(1S,11S,13R,15R)-15-[(2R,3S,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7-hydroxy-9-oxo-10,17-dioxatricyclo[11.3.1.03,8]heptadeca-3(8),4,6-trien-11-yl]prop-1-enyl]hepta-2,4-dienamide
Structure
SMILES: CC/C=C\C=C/C(O)=N/C=C/C[C@H]1C[C@H]2C[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3N=C(C)O)C[C@H](CC3=CC=CC(O)=C3C(=O)O1)O2
InChI: InChI=1S/C33H44N2O11/c1-3-4-5-6-12-27(39)34-13-8-10-21-15-23-17-24(45-33-29(35-19(2)37)31(41)30(40)26(18-36)46-33)16-22(43-23)14-20-9-7-11-25(38)28(20)32(42)44-21/h4-9,11-13,21-24,26,29-31,33,36,38,40-41H,3,10,14-18H2,1-2H3,(H,34,39)(H,35,37)/b5-4-,12-6-,13-8+/t21-,22-,23-,24+,26+,29-,30+,31+,33+/m0/s1
InChIKey: JVMDGHNCVYGPGG-OMNYSOFZSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Chondromyces robustus | Chondromyces | Polyangiaceae | Polyangiales | None | Myxococcota | None | Bacteria |
Properties Information
Molecule Weight: 644.7180000000003
TPSA？: 200.09
MolLogP？: 2.9633000000000016
Number of H-Donors: 6
Number of H-Acceptors: 11
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|