Cadystin A
AlkaPlorer ID: AK049361
Synonym: None
IUPAC Name: (2S)-2-amino-5-[[(2R)-1-[[(1S)-1-carboxy-4-[[(2R)-1-[[(1S)-1-carboxy-4-[[(2R)-1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-4-oxobutyl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-4-oxobutyl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid
Structure
SMILES: N[C@@H](CCC(O)=N[C@@H](CS)C(O)=N[C@@H](CCC(O)=N[C@@H](CS)C(O)=N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O)C(=O)O)C(=O)O
InChI: InChI=1S/C26H41N7O14S3/c27-11(24(42)43)1-4-17(34)30-15(9-49)22(40)32-13(26(46)47)3-6-19(36)31-16(10-50)23(41)33-12(25(44)45)2-5-18(35)29-14(8-48)21(39)28-7-20(37)38/h11-16,48-50H,1-10,27H2,(H,28,39)(H,29,35)(H,30,34)(H,31,36)(H,32,40)(H,33,41)(H,37,38)(H,42,43)(H,44,45)(H,46,47)/t11-,12-,13-,14-,15-,16-/m0/s1
InChIKey: PCOMFCPXXQONPD-QNILMXGZSA-N
Reference
PubChem CID: 174541
CAS: 86220-45-3
LOTUS: LTS0208838
SuperNatural Ⅲ: SN0281739-02
{NPAtlas: NPA003068
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Schizosaccharomyces pombe | Schizosaccharomyces | Schizosaccharomycetaceae | Schizosaccharomycetales | Schizosaccharomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 771.8500000000004
TPSA？: 370.76
MolLogP？: 0.3641000000000046
Number of H-Donors: 14
Number of H-Acceptors: 14
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|