(2S)-2-{2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-{[(2R)-1-[(2S)-2-[(2S)-2-(2-aminoacetamido)-4-methylpentanamido]-3-methylbutanoyl]pyrrolidin-2-yl]formamido}-3-carbamoylpropanamido]-4-methylpentanamido]-4-methylpentanamido]-3-carbamoylpropanamido
AlkaPlorer ID: AK588444
Synonym: None
IUPAC Name: 2-[[2-[[2-[[4-amino-2-[[4-amino-2-[[2-[[2-[[4-amino-2-[[1-[2-[[2-[(2-aminoacetyl)amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]-4-oxobutanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-4-oxobutanoyl]amino]-4-oxobutanoyl]amino]-4-methylpentanoyl]amino]acetyl]amino]-4-methylpentanoic acid
Structure
SMILES: CC(C)CC(N=C(O)CN=C(O)C(CC(C)C)N=C(O)C(CC(=N)O)N=C(O)C(CC(=N)O)N=C(O)C(CC(C)C)N=C(O)C(CC(C)C)N=C(O)C(CC(=N)O)N=C(O)C1CCCN1C(=O)C(N=C(O)C(CC(C)C)N=C(O)CN)C(C)C)C(=O)O
InChI: InChI=1S/C56H97N15O16/c1-26(2)16-32(47(77)61-25-45(76)63-39(56(86)87)20-30(9)10)64-50(80)36(21-41(58)72)68-51(81)37(22-42(59)73)67-49(79)35(19-29(7)8)65-48(78)34(18-28(5)6)66-52(82)38(23-43(60)74)69-54(84)40-14-13-15-71(40)55(85)46(31(11)12)70-53(83)33(17-27(3)4)62-44(75)24-57/h26-40,46H,13-25,57H2,1-12H3,(H2,58,72)(H2,59,73)(H2,60,74)(H,61,77)(H,62,75)(H,63,76)(H,64,80)(H,65,78)(H,66,82)(H,67,79)(H,68,81)(H,69,84)(H,70,83)(H,86,87)
InChIKey: ZASQPPODMTYWSQ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Limnodynastes terraereginae | Limnodynastes | Limnodynastidae | Anura | Amphibia | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 1236.4809999999995
TPSA？: 541.7700000000001
MolLogP？: 7.565710000000017
Number of H-Donors: 18
Number of H-Acceptors: 16
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|