(2S)-2-{2-[(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-{2-[(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)propanamido]-3-methylbutanamido]-3-hydroxypropanamido]acetamido}-4-methylpentanamido]-4-methylpentanamido]-3-hydroxybutanamido]-3-carbamoylpropanamido]-4-met
AlkaPlorer ID: AK337571
Synonym: None
IUPAC Name: 2-[[2-[[2-[[4-amino-2-[[2-[[2-[[2-[[2-[[2-[[2-[2-[(2-aminoacetyl)amino]propanoylamino]-3-methylbutanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]-4-oxobutanoyl]amino]-4-methylpentanoyl]amino]acetyl]amino]-4-methylpentanoic acid
Structure
SMILES: CC(C)CC(NC(=O)CNC(=O)C(CC(C)C)NC(=O)C(CC(N)=O)NC(=O)C(NC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)CNC(=O)C(CO)NC(=O)C(NC(=O)C(C)NC(=O)CN)C(C)C)C(C)O)C(=O)O
InChI: InChI=1S/C49H87N13O16/c1-22(2)13-29(42(70)52-20-38(68)56-33(49(77)78)16-25(7)8)57-45(73)32(17-35(51)65)59-48(76)40(28(12)64)62-46(74)31(15-24(5)6)58-44(72)30(14-23(3)4)55-37(67)19-53-43(71)34(21-63)60-47(75)39(26(9)10)61-41(69)27(11)54-36(66)18-50/h22-34,39-40,63-64H,13-21,50H2,1-12H3,(H2,51,65)(H,52,70)(H,53,71)(H,54,66)(H,55,67)(H,56,68)(H,57,73)(H,58,72)(H,59,76)(H,60,75)(H,61,69)(H,62,74)(H,77,78)
InChIKey: AVNHJRDZHLHVSN-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Limnodynastes salmini | Limnodynastes | Limnodynastidae | Anura | Amphibia | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 1114.3099999999995
TPSA？: 466.9699999999999
MolLogP？: -5.265900000000023
Number of H-Donors: 16
Number of H-Acceptors: 16
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|