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Chemical structure of Lyciumin A

GC69417

Lyciumin A

Also known as 11-(hydroxymethyl)-2-[[3-(4-hydroxyphenyl)-2-[[1-(5-oxopyrrolidine-2-carbonyl)pyrrolidine-2-carbonyl]amino]propanoyl]amino]-3,6,9,12-tetraoxo-5-propan-2-yl-1,4,7,10,13-pentazatricyclo[14.6.1.017,22]tricosa-16(23),17,19,21-tetraene-14-carboxylic acid

Lyciumin A is a cyclic octapeptide that exhibits inhibitory activity against proteases, renin, and angiotensin-converting enzyme· Lyciumin A can be used for research on hypertension

ChemicalCAS125708-06-7MW873.91FormulaC42H51N9O12
CAS number
125708-06-7
Molecular weight
873.91
Formula
C42H51N9O12
InChIKey
IPOLXDNCMOVXCP-UHFFFAOYSA-N
Catalogue number
GC69417
Brand
GLPBIO
Computed properties PubChem CID 14430290 · XLogP 0.3 · TPSA 307 Ų · H-bond donors 10
XLogP
0.3
TPSA
307 Ų
H-bond donors
10
H-bond acceptors
12
Rotatable bonds
10
Heavy atoms
63

SMILES CC(C)C1C(=O)NCC(=O)NC(C(=O)NC(CC2=CN(C(C(=O)N1)NC(=O)C(CC3=CC=C(C=C3)O)NC(=O)C4CCCN4C(=O)C5CCC(=O)N5)C6=CC=CC=C26)C(=O)O)CO

Computed descriptors from PubChem (CID 14430290), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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