Leucocin B-TA11A
AlkaPlorer ID: AK326109
Synonym: None
IUPAC Name: 3-[2-[[2-[[6-amino-2-[[2-[[4-amino-2-[[4-amino-2-[(2-amino-4-methylsulfanylbutanoyl)amino]-4-oxobutanoyl]amino]-4-oxobutanoyl]amino]-4-methylsulfanylbutanoyl]amino]hexanoyl]amino]-3-hydroxypropanoyl]amino]propanoylamino]-4-[[4-amino-1-[[1-(4-hydroxyphenyl)-3-oxopropan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-4-oxobutanoic acid
Structure
SMILES: CSCCC(N)C(=O)NC(CC(N)=O)C(=O)NC(CC(N)=O)C(=O)NC(CCSC)C(=O)NC(CCCCN)C(=O)NC(CO)C(=O)NC(C)C(=O)NC(CC(=O)O)C(=O)NC(CC(N)=O)C(=O)NC(C=O)CC1=CC=C(O)C=C1
InChI: InChI=1S/C47H74N14O17S2/c1-23(39(70)57-33(20-38(68)69)46(77)59-30(17-35(50)65)43(74)54-25(21-62)16-24-7-9-26(64)10-8-24)53-47(78)34(22-63)61-41(72)28(6-4-5-13-48)55-42(73)29(12-15-80-3)56-44(75)32(19-37(52)67)60-45(76)31(18-36(51)66)58-40(71)27(49)11-14-79-2/h7-10,21,23,25,27-34,63-64H,4-6,11-20,22,48-49H2,1-3H3,(H2,50,65)(H2,51,66)(H2,52,67)(H,53,78)(H,54,74)(H,55,73)(H,56,75)(H,57,70)(H,58,71)(H,59,77)(H,60,76)(H,61,72)(H,68,69)
InChIKey: GJULFBNAGMRDSE-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Leuconostoc carnosum | Leuconostoc | Lactobacillaceae | Lactobacillales | Bacilli | Bacillota | None | Bacteria |
Properties Information
Molecule Weight: 1171.3239999999998
TPSA？: 538.0399999999998
MolLogP？: -7.427600000000008
Number of H-Donors: 17
Number of H-Acceptors: 20
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|