methyl (2S,4R)-4-carbamoyl-4-hydroxy-2-[(2R)-3-{2-[(2R,3S,6R,8E,10E,14S)-3-hydroxy-2,6,10,14-tetramethyl-7-oxoicosa-8,10-dienamido]prop-2-enamido}-2-methylpropanamido]butanoate
AlkaPlorer ID: AK596660
Synonym: None
IUPAC Name: methyl 5-amino-4-hydroxy-2-[[3-[2-[(3-hydroxy-2,6,10,14-tetramethyl-7-oxoicosa-8,10-dienoyl)amino]prop-2-enoylamino]-2-methylpropanoyl]amino]-5-oxopentanoate
Structure
SMILES: C=C(N=C(O)C(C)C(O)CCC(C)C(=O)C=CC(C)=CCCC(C)CCCCCC)C(O)=NCC(C)C(O)=NC(CC(O)C(=N)O)C(=O)OC
InChI: InChI=1S/C37H62N4O9/c1-9-10-11-12-14-23(2)15-13-16-24(3)17-19-30(42)25(4)18-20-31(43)27(6)35(47)40-28(7)36(48)39-22-26(5)34(46)41-29(37(49)50-8)21-32(44)33(38)45/h16-17,19,23,25-27,29,31-32,43-44H,7,9-15,18,20-22H2,1-6,8H3,(H2,38,45)(H,39,48)(H,40,47)(H,41,46)
InChIKey: ZTZIEGYSNYKERE-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Candida tropicalis | Candida | Debaryomycetaceae | Saccharomycetales | Saccharomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 706.9220000000005
TPSA？: 225.68
MolLogP？: 6.705170000000007
Number of H-Donors: 7
Number of H-Acceptors: 9
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|