Leucamide A
AlkaPlorer ID: AK151025
Synonym: ''
IUPAC Name: (8S,15S,21S,24S)-15-[(2R)-butan-2-yl]-4,8-dimethyl-24-propan-2-yl-3,10-dioxa-26-thia-7,14,17,23,28,29,30-heptazapentacyclo[23.2.1.12,5.19,12.017,21]triaconta-1(27),2(30),4,9(29),11,25(28)-hexaene-6,13,16,22-tetrone
Structure
SMILES: CC[C@@H](C)[C@@H]1N=C(O)C2=COC(=N2)[C@H](C)N=C(O)C2=C(C)OC(=N2)C2=CSC(=N2)[C@H](C(C)C)N=C(O)[C@@H]2CCCN2C1=O
InChI: InChI=1S/C29H37N7O6S/c1-7-14(4)21-29(40)36-10-8-9-19(36)24(38)33-20(13(2)3)28-32-18(12-43-28)27-35-22(16(6)42-27)25(39)30-15(5)26-31-17(11-41-26)23(37)34-21/h11-15,19-21H,7-10H2,1-6H3,(H,30,39)(H,33,38)(H,34,37)/t14-,15+,19+,20+,21+/m1/s1
InChIKey: ZOJFOVAOHXYUBB-LYNWBYMPSA-N
Reference
Leucamide A: A New Cytotoxic Heptapeptide from the Australian Sponge <i>Leucetta microraphis</i>
PubChem CID: 163106919
LOTUS: LTS0035459
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Leucetta microraphis | Leucetta | Leucettidae | Clathrinida | Calcarea | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 611.725
TPSA？: 183.03
MolLogP？: 5.537820000000005
Number of H-Donors: 3
Number of H-Acceptors: 10
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|