Sclerotiamide; (-)-form, 5-Chloro
AlkaPlorer ID: AK313114
Synonym: 5-Chlorosclerotiamide
IUPAC Name: 5-chloro-12'-hydroxy-7,7,10',10'-tetramethylspiro[1H-pyrano[2,3-g]indole-3,11'-3,13-diazatetracyclo[5.5.2.01,9.03,7]tetradecane]-2,2',14'-trione
Structure
SMILES: CC1(C)C=CC2=C(O1)C(Cl)=CC1=C2N=C(O)C12C(O)C13N=C(O)C4(CCCN4C1=O)CC3C2(C)C
InChI: InChI=1S/C26H28ClN3O5/c1-22(2)8-6-12-16-13(10-14(27)17(12)35-22)25(20(33)28-16)18(31)26-15(23(25,3)4)11-24(19(32)29-26)7-5-9-30(24)21(26)34/h6,8,10,15,18,31H,5,7,9,11H2,1-4H3,(H,28,33)(H,29,32)
InChIKey: TVZRVAVYSDCSKC-UHFFFAOYSA-N
Reference
Alkaloids from the Deep-Sea-Derived Fungus <i>Aspergillus westerdijkiae</i> DFFSCS013
PubChem CID: 78155617
LOTUS: LTS0151706
COCONUT: CNP0131603.3
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus westerdijkiae | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 497.9790000000004
TPSA？: 114.95
MolLogP？: 3.854300000000003
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|