Tenuecyclamide D
AlkaPlorer ID: AK014512
Synonym: None
IUPAC Name: (4S,18S)-4,7-dimethyl-18-(2-methylsulfinylethyl)-6-oxa-13,20-dithia-3,10,17,22,23,24-hexazatetracyclo[17.2.1.15,8.112,15]tetracosa-1(21),5(24),7,12(23),14,19(22)-hexaene-2,9,16-trione
Structure
SMILES: CC1=C2N=C(O1)[C@H](C)N=C(O)C1=CSC(=N1)[C@H](CCS(C)=O)N=C(O)C1=CSC(=N1)CN=C2O
InChI: InChI=1S/C20H22N6O5S3/c1-9-19-26-15(10(2)31-19)18(29)21-6-14-23-12(7-32-14)17(28)24-11(4-5-34(3)30)20-25-13(8-33-20)16(27)22-9/h7-9,11H,4-6H2,1-3H3,(H,21,29)(H,22,27)(H,24,28)/t9-,11-,34?/m0/s1
InChIKey: ILKYNUWKOMIMLZ-KMLOPCPQSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Nostoc spongiaeforme | Nostoc | Nostocaceae | Nostocales | Cyanophyceae | Cyanobacteriota | None | Bacteria |
Properties Information
Molecule Weight: 522.6340000000004
TPSA？: 166.65
MolLogP？: 3.594520000000002
Number of H-Donors: 3
Number of H-Acceptors: 10
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Paracentrotus lividus | Paracentrotus lividus | ED100 | 19.1 | uM | 10.1021/np980138j |