None
AlkaPlorer ID: AK513723
Synonym: None
IUPAC Name: (2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-5-amino-1-[[(2S)-4-methyl-1-oxo-1-[[(2R)-1-oxo-1-[(2S)-2-[[(2S)-1-oxo-1-[[(2R)-1-oxo-3-phenylpropan-2-yl]amino]-3-phenylpropan-2-yl]carbamoyl]pyrrolidin-1-yl]-3-phenylpropan-2-yl]amino]pentan-2-yl]amino]-1-oxopentan-2-yl]amino]-3-methyl-1-oxobut-3-en-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]pentanediamide
Structure
SMILES: C=C(C)[C@H](N=C(O)[C@H](CC1=CC=C(O)C=C1)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@@H](N)CC(=N)O)C(O)=N[C@@H](CCCN)C(O)=N[C@@H](CC(C)C)C(O)=N[C@H](CC1=CC=CC=C1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CC1=CC=CC=C1)C(O)=N[C@@H](C=O)CC1=CC=CC=C1
InChI: InChI=1S/C66H87N13O13/c1-39(2)32-50(62(88)77-53(36-43-20-12-7-13-21-43)66(92)79-31-15-23-54(79)64(90)76-51(34-42-18-10-6-11-19-42)61(87)71-45(38-80)33-41-16-8-5-9-17-41)74-59(85)48(22-14-30-67)73-65(91)57(40(3)4)78-63(89)52(35-44-24-26-46(81)27-25-44)75-60(86)49(28-29-55(69)82)72-58(84)47(68)37-56(70)83/h5-13,16-21,24-27,38-39,45,47-54,57,81H,3,14-15,22-23,28-37,67-68H2,1-2,4H3,(H2,69,82)(H2,70,83)(H,71,87)(H,72,84)(H,73,91)(H,74,85)(H,75,86)(H,76,90)(H,77,88)(H,78,89)/t45-,47+,48+,49+,50+,51+,52+,53-,54+,57+/m1/s1
InChIKey: RNYCIGPDZRCZCZ-RGCPQTOTSA-N
Reference
The Chemistry of Tyrocidine. III. The Structure of Tyrocidine A
PubChem CID: 16131441
LOTUS: LTS0253091
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Brevibacillus brevis | Brevibacillus | Paenibacillaceae | Bacillales | Bacilli | Bacillota | None | Bacteria |
Properties Information
Molecule Weight: 1270.4999999999995
TPSA？: 458.5300000000001
MolLogP？: 8.382740000000016
Number of H-Donors: 15
Number of H-Acceptors: 15
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|