155660-92-7
AlkaPlorer ID: AK057658
Synonym: '', 'Bistramide K'
IUPAC Name: (3S,4S,6E,9R,10E)-3,9-dihydroxy-N-[(2R,3S)-2-hydroxy-4-[3-[(2R,3S,6S,8S)-8-[(E,3S,6S)-6-hydroxy-3,5-dimethylhept-4-enyl]-3-methyl-1,7-dioxaspiro[5.5]undecan-2-yl]propylamino]-3-methyl-4-oxobutyl]-4-methyldodeca-6,10-dienamide
Structure
SMILES: C/C=C/[C@H](O)C/C=C/C[C@H](C)[C@@H](O)CC(O)=NC[C@H](O)[C@H](C)C(O)=NCCC[C@H]1O[C@@]2(CCC[C@@H](CC[C@H](C)/C=C(\C)[C@H](C)O)O2)CC[C@@H]1C
InChI: InChI=1S/C40H70N2O8/c1-8-13-33(44)15-10-9-14-28(3)35(45)25-38(47)42-26-36(46)31(6)39(48)41-23-12-17-37-29(4)20-22-40(50-37)21-11-16-34(49-40)19-18-27(2)24-30(5)32(7)43/h8-10,13,24,27-29,31-37,43-46H,11-12,14-23,25-26H2,1-7H3,(H,41,48)(H,42,47)/b10-9+,13-8+,30-24+/t27-,28-,29-,31-,32-,33-,34-,35-,36-,37+,40-/m0/s1
InChIKey: VBQUNUFYTUOFSU-JBBCPXDWSA-N
Reference
Bistramides A, B, C, D, and K: A New Class of Bioactive Cyclic Polyethers from Lissoclinum bistratum
PubChem CID: 101676766
LOTUS: LTS0150686
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Lissoclinum bistratum | Lissoclinum | Didemnidae | Aplousobranchia | Ascidiacea | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 707.0060000000002
TPSA？: 164.55999999999997
MolLogP？: 7.161000000000009
Number of H-Donors: 6
Number of H-Acceptors: 8
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|