Nannochelin B
AlkaPlorer ID: AK053690
Synonym: None
IUPAC Name: 2-[2-[[(1S)-1-carboxy-5-[hydroxy-[(E)-3-phenylprop-2-enoyl]amino]pentyl]amino]-2-oxoethyl]-2-hydroxy-4-[[(2S)-6-[hydroxy-[(E)-3-phenylprop-2-enoyl]amino]-1-methoxy-1-oxohexan-2-yl]amino]-4-oxobutanoic acid
Structure
SMILES: COC(=O)[C@H](CCCCN(O)C(=O)/C=C/C1=CC=CC=C1)N=C(O)CC(O)(CC(O)=N[C@@H](CCCCN(O)C(=O)/C=C/C1=CC=CC=C1)C(=O)O)C(=O)O
InChI: InChI=1S/C37H46N4O13/c1-54-35(48)29(17-9-11-23-41(53)33(45)21-19-27-14-6-3-7-15-27)39-31(43)25-37(51,36(49)50)24-30(42)38-28(34(46)47)16-8-10-22-40(52)32(44)20-18-26-12-4-2-5-13-26/h2-7,12-15,18-21,28-29,51-53H,8-11,16-17,22-25H2,1H3,(H,38,42)(H,39,43)(H,46,47)(H,49,50)/b20-18+,21-19+/t28-,29-,37?/m0/s1
InChIKey: MSIKUOJWOBZEKW-UYXGXLLSSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Nannocystis exedens | Nannocystis | Nannocystaceae | Nannocystales | None | Myxococcota | None | Bacteria |
Properties Information
Molecule Weight: 754.7900000000005
TPSA？: 267.39
MolLogP？: 3.693100000000001
Number of H-Donors: 7
Number of H-Acceptors: 11
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|