Brasilane A
AlkaPlorer ID: AK325512
Synonym: None
IUPAC Name: N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2E)-2-(1,6,6-trimethyl-2,3,3a,5,7,7a-hexahydro-1H-inden-4-ylidene)propoxy]oxan-3-yl]acetamide
Structure
SMILES: CC(O)=N[C@H]1[C@@H](OC/C(C)=C2\CC(C)(C)CC3C(C)CCC23)O[C@H](CO)[C@@H](O)[C@@H]1O
InChI: InChI=1S/C23H39NO6/c1-12-6-7-15-16(12)8-23(4,5)9-17(15)13(2)11-29-22-19(24-14(3)26)21(28)20(27)18(10-25)30-22/h12,15-16,18-22,25,27-28H,6-11H2,1-5H3,(H,24,26)/b17-13+/t12?,15?,16?,18-,19-,20-,21-,22+/m1/s1
InChIKey: ZTCHPQNUISFMBP-DYUSRDENSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Coltricia | Hymenochaetaceae | Hymenochaetales | Agaricomycetes | Basidiomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 425.56600000000014
TPSA？: 111.74000000000002
MolLogP？: 2.585800000000001
Number of H-Donors: 4
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|