Speradine F
AlkaPlorer ID: AK089462
Synonym: None
IUPAC Name: (1R,2R,3S,4R,5S,9R)-5-acetyl-3,4,5-trihydroxy-8,8,16-trimethyl-19-oxa-7,16-diazahexacyclo[9.6.1.11,4.02,9.03,7.015,18]nonadeca-11(18),12,14-triene-6,17-dione
Structure
SMILES: CC(=O)[C@@]1(O)C(=O)N2C(C)(C)[C@@H]3CC4=CC=CC5=C4[C@@]4(O[C@@]1(O)[C@@]2(O)[C@H]34)C(=O)N5C
InChI: InChI=1S/C21H22N2O7/c1-9(24)19(27)16(26)23-17(2,3)11-8-10-6-5-7-12-13(10)18(15(25)22(12)4)14(11)20(23,28)21(19,29)30-18/h5-7,11,14,27-29H,8H2,1-4H3/t11-,14-,18+,19-,20+,21-/m1/s1
InChIKey: QLOOWQVCXQPADP-UMHNQWNOSA-N
Reference
Penicamedine A, a Highly Oxygenated Hexacyclic Indole Alkaloid from <i>Penicillium camemberti</i>
PubChem CID: 139587045
LOTUS: LTS0119722
{NPAtlas: NPA015342
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus oryzae | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
| Penicillium camemberti | Penicillium | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 414.41400000000016
TPSA？: 127.61
MolLogP？: -0.9913
Number of H-Donors: 3
Number of H-Acceptors: 7
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|