Molecule

Not named

AlkaPlorer ID: AK025920

Synonym: None

IUPAC Name: (2S)-2-[[(5R)-5-amino-7-[[(1S)-1-carboxy-2-phenylethyl]amino]-7-oxoheptanoyl]amino]-3-phenylpropanoic acid

Structure

SMILES: N[C@H](CCCC(O)=N[C@@H](CC1=CC=CC=C1)C(=O)O)CC(O)=N[C@@H](CC1=CC=CC=C1)C(=O)O

InChI: InChI=1S/C25H31N3O6/c26-19(16-23(30)28-21(25(33)34)15-18-10-5-2-6-11-18)12-7-13-22(29)27-20(24(31)32)14-17-8-3-1-4-9-17/h1-6,8-11,19-21H,7,12-16,26H2,(H,27,29)(H,28,30)(H,31,32)(H,33,34)/t19-,20+,21+/m1/s1

InChIKey: YDRFWTMLXCWRLI-HKBOAZHASA-N

Reference

Application of Cell Culture for the Production of Bioactive Compounds from Sponges: Synthesis of Avarol by Primmorphs from <i>Dysidea</i> <i>avara</i>

PubChem CID: 163072908

LOTUS: LTS0046506

SuperNatural Ⅲ: SN0447551-02

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Dysidea fragilis	Dysidea	Dysideidae	Dictyoceratida	Demospongiae	Porifera	Metazoa	Eukaryota

Properties Information

Molecule Weight: 469.5380000000002

TPSA？: 165.79999999999998

MolLogP？: 3.1789000000000005

Number of H-Donors: 5

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi