Molecule

Cyclo-(D-Ile-L-Trp)

AlkaPlorer ID: AK054804

Synonym: '', 'cyclo(D-Ile-L-Trp)', 'Cyclo-(D-Ile-L-Trp)'

IUPAC Name: (3R,6S)-3-[(2S)-butan-2-yl]-6-(1H-indol-3-ylmethyl)piperazine-2,5-dione

Structure

SMILES: CC[C@H](C)[C@H]1N=C(O)[C@H](CC2=CNC3=CC=CC=C23)N=C1O

InChI: InChI=1S/C17H21N3O2/c1-3-10(2)15-17(22)19-14(16(21)20-15)8-11-9-18-13-7-5-4-6-12(11)13/h4-7,9-10,14-15,18H,3,8H2,1-2H3,(H,19,22)(H,20,21)/t10-,14-,15+/m0/s1

InChIKey: PGCNHGBQEYFZEX-NZVBXONLSA-N

Reference

Brevicompanine C, Cyclo-(<scp>d</scp>-Ile-<scp>l</scp>-Trp), and Cyclo-(<scp>d</scp>-Leu-<scp>l</scp>-Trp), Plant Growth Regulators from Penicillium brevi-compactum

PubChem CID: 44575417

LOTUS: LTS0039321

NPASS: NPC474561

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Penicillium brevicompactum	Penicillium	Aspergillaceae	Eurotiales	Eurotiomycetes	Ascomycota	Fungi	Eukaryota

Properties Information

Molecule Weight: 299.374

TPSA？: 80.97

MolLogP？: 3.420300000000001

Number of H-Donors: 3

Number of H-Acceptors: 2

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Lactuca sativa	Lactuca sativa	Activity	167.0	%	10.1021/np040178p
Lactuca sativa	Lactuca sativa	Activity	nan	None	10.1021/np040178p