Lactocillin
AlkaPlorer ID: AK303897
Synonym: None
IUPAC Name: None
Structure
SMILES: CC=C1NC(=O)C(C(C)O)NC(=O)C2=CSC(=N2)C2=CC=C(C3=NC(C4=NC(C(=O)NC(C)C(=O)O)=CS4)=CS3)N=C2C2=CSC(=N2)C(CSC(=O)C2=CNC3=CC=CC=C23)NC(=O)C2CSC(=N2)C(C(C)O)NC(=O)C2=CSC1=N2
InChI: InChI=1S/C51H45N13O10S7/c1-5-26-45-59-33(16-77-45)42(70)64-37(22(4)66)49-61-31(17-80-49)40(68)56-34(19-81-51(74)25-12-52-27-9-7-6-8-23(25)27)47-57-29(13-76-47)38-24(44-58-32(14-75-44)41(69)63-36(21(3)65)43(71)55-26)10-11-28(54-38)46-62-35(18-79-46)48-60-30(15-78-48)39(67)53-20(2)50(72)73/h5-16,18,20-22,31,34,36-37,52,65-66H,17,19H2,1-4H3,(H,53,67)(H,55,71)(H,56,68)(H,63,69)(H,64,70)(H,72,73)
InChIKey: WTPCCOAKKCTBIB-UHFFFAOYSA-N
Reference
CAS: 1629150-63-5
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Lactobacillus gasseri | Lactobacillus | Lactobacillaceae | Lactobacillales | Bacilli | Bacillota | None | Bacteria |
Properties Information
Molecule Weight: 1224.471
TPSA?: 345.81999999999994
MolLogP?: 6.110300000000006
Number of H-Donors: 9
Number of H-Acceptors: 23
RingCount: 10
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|
