Bistramide A
AlkaPlorer ID: AK176019
Synonym: 'Bistratene A'
IUPAC Name: (2S,3R)-3-hydroxy-N-[4-[(2S,6S,8R)-2-[(E,3S,6S)-6-hydroxy-3,5-dimethylhept-4-enyl]-1,7-dioxaspiro[5.5]undecan-8-yl]butyl]-2-methyl-4-[[2-[(2S,3S,6R)-3-methyl-6-[(E)-2-oxopent-3-enyl]oxan-2-yl]acetyl]amino]butanamide
Structure
SMILES: C/C=C/C(=O)C[C@H]1CC[C@H](C)[C@H](CC(O)=NC[C@H](O)[C@H](C)C(O)=NCCCC[C@@H]2CCC[C@]3(CCC[C@@H](CC[C@H](C)/C=C(\C)[C@H](C)O)O3)O2)O1
InChI: InChI=1S/C40H68N2O8/c1-7-12-32(44)24-35-19-17-28(3)37(48-35)25-38(46)42-26-36(45)30(5)39(47)41-22-9-8-13-33-14-10-20-40(49-33)21-11-15-34(50-40)18-16-27(2)23-29(4)31(6)43/h7,12,23,27-28,30-31,33-37,43,45H,8-11,13-22,24-26H2,1-6H3,(H,41,47)(H,42,46)/b12-7+,29-23+/t27-,28-,30-,31-,33+,34-,35+,36-,37-,40-/m0/s1
InChIKey: JTYXFVLXXQMJHM-BGWIWUEPSA-N
Reference
Bistramides A, B, C, D, and K: A New Class of Bioactive Cyclic Polyethers from Lissoclinum bistratum
PubChem CID: 163104626
LOTUS: LTS0018611
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Trididemnum cyclops | Trididemnum | Didemnidae | Aplousobranchia | Ascidiacea | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 704.9900000000005
TPSA？: 150.39999999999998
MolLogP？: 7.753700000000009
Number of H-Donors: 4
Number of H-Acceptors: 8
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|