Cupriachelin
AlkaPlorer ID: AK079873
Synonym: None
IUPAC Name: (2S)-2-[[2-[[(2S,3S)-2-[[(2S)-4-amino-2-[[(2S,3S)-3-carboxy-2-(decanoylamino)-3-hydroxypropanoyl]amino]butanoyl]amino]-3-carboxy-3-hydroxypropanoyl]amino]acetyl]amino]-5-[hydroxy-[(3S)-3-hydroxybutanoyl]amino]pentanoic acid
Structure
SMILES: CCCCCCCCCC(O)=N[C@H](C(O)=N[C@@H](CCN)C(O)=N[C@H](C(O)=NCC(O)=N[C@@H](CCCN(O)C(=O)C[C@H](C)O)C(=O)O)[C@H](O)C(=O)O)[C@H](O)C(=O)O
InChI: InChI=1S/C33H57N7O16/c1-3-4-5-6-7-8-9-12-21(42)38-25(27(46)33(54)55)30(49)37-19(13-14-34)28(47)39-24(26(45)32(52)53)29(48)35-17-22(43)36-20(31(50)51)11-10-15-40(56)23(44)16-18(2)41/h18-20,24-27,41,45-46,56H,3-17,34H2,1-2H3,(H,35,48)(H,36,43)(H,37,49)(H,38,42)(H,39,47)(H,50,51)(H,52,53)(H,54,55)/t18-,19-,20-,24-,25-,26-,27-/m0/s1
InChIKey: NKYSSGMAMSGPMC-UBFCWUJISA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Necator | Ancylostomatidae | Rhabditida | Chromadorea | Nematoda | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 807.8520000000007
TPSA？: 402.1
MolLogP？: 0.4773000000000089
Number of H-Donors: 13
Number of H-Acceptors: 14
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|