2,29-diaminotriacontane-3,28-diol
AlkaPlorer ID: AK149818
Synonym: None
IUPAC Name: (2R,3S,28S,29R)-2,29-diaminotriacontane-3,28-diol
Structure
SMILES: C[C@@H](N)[C@@H](O)CCCCCCCCCCCCCCCCCCCCCCCC[C@H](O)[C@@H](C)N
InChI: InChI=1S/C30H64N2O2/c1-27(31)29(33)25-23-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-24-26-30(34)28(2)32/h27-30,33-34H,3-26,31-32H2,1-2H3/t27-,28-,29+,30+/m1/s1
InChIKey: SUOKTYFGZNMWLR-XAZDILKDSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Leucetta | Leucettidae | Clathrinida | Calcarea | Porifera | Metazoa | Eukaryota |
| None | Leucetta | Leucettidae | Clathrinida | Calcarea | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 484.8540000000005
TPSA？: 92.5
MolLogP？: 7.7650000000000095
Number of H-Donors: 4
Number of H-Acceptors: 4
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Ubiquitin-conjugating enzyme E2 N/Ubiquitin-conjugating enzyme E2 variant 1 | IC50 | 4.0 | ug.mL-1 | 10.1016/j.bmcl.2008.10.110 |