Spliceostatin G
AlkaPlorer ID: AK071286
Synonym: None
IUPAC Name: (2E,4E)-6-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-4-methylhexa-2,4-dienoic acid
Structure
SMILES: CC(=O)O[C@@H](C)/C=C\C(O)=N[C@@H]1C[C@H](C)[C@H](C/C=C(C)/C=C/C(=O)O)O[C@@H]1C
InChI: InChI=1S/C21H31NO6/c1-13(7-11-21(25)26)6-9-19-14(2)12-18(16(4)28-19)22-20(24)10-8-15(3)27-17(5)23/h6-8,10-11,14-16,18-19H,9,12H2,1-5H3,(H,22,24)(H,25,26)/b10-8-,11-7+,13-6+/t14-,15-,16+,18+,19-/m0/s1
InChIKey: SPJBXWLUCQGFSA-OGGYWXJKSA-N
Reference
Cytotoxic Spliceostatins from <i>Burkholderia</i> sp. and Their Semisynthetic Analogues
PubChem CID: 118711959
LOTUS: LTS0164908
NPASS: NPC480802
{NPAtlas: NPA010319
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Burkholderia sp. | Burkholderia | Burkholderiaceae | Burkholderiales | Betaproteobacteria | Pseudomonadota | None | Bacteria |
| Burkholderia sp. FERM BP-3421 | Burkholderia | Burkholderiaceae | Burkholderiales | Betaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 393.4800000000001
TPSA？: 105.42000000000002
MolLogP？: 3.610000000000002
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | BT-474 | IC50 | 100.0 | nM | 10.1021/np500342m |
| Homo sapiens | MDA-MB-468 | IC50 | nan | None | 10.1021/np500342m |
| Homo sapiens | NCI-H1975 | IC50 | nan | None | 10.1021/np500342m |
| Homo sapiens | NCI-N87 | IC50 | 100.0 | nM | 10.1021/np500342m |
| None | NON-PROTEIN TARGET | IC50 | 100.0 | nM | 10.1021/np500342m |