(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]propanamido]-4-methylpentanamido]propanamido]hexanamido]-4-methylpentanamido]-N-[(1S)-1-carbamoyl-3-methylbutyl]butanediamide
AlkaPlorer ID: AK214094
Synonym: None
IUPAC Name: (2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]hexanoyl]amino]-4-methylpentanoyl]amino]-N-[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]butanediamide
Structure
SMILES: CC(C)C[C@H](N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](CCCCN)N=C(O)[C@H](C)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](C)N=C(O)[C@H](C)N)C(=N)O
InChI: InChI=1S/C37H69N11O9/c1-18(2)14-25(30(41)50)45-37(57)28(17-29(40)49)48-36(56)27(16-20(5)6)47-34(54)24(12-10-11-13-38)44-32(52)23(9)43-35(55)26(15-19(3)4)46-33(53)22(8)42-31(51)21(7)39/h18-28H,10-17,38-39H2,1-9H3,(H2,40,49)(H2,41,50)(H,42,51)(H,43,55)(H,44,52)(H,45,57)(H,46,53)(H,47,54)(H,48,56)/t21-,22-,23-,24-,25-,26-,27-,28-/m0/s1
InChIKey: JCXLUMOMJGICSW-VXBMVYAYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Vespa orientalis | Vespa | Vespidae | Hymenoptera | Insecta | Arthropoda | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 812.027
TPSA？: 368.33
MolLogP？: 5.377040000000009
Number of H-Donors: 13
Number of H-Acceptors: 11
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|