Undecylprodigiosin

AlkaPlorer ID: AK016436

Synonym: Undecylprodiginine, Prodigiosin 25c

IUPAC Name: 3-methoxy-5-(1H-pyrrol-2-yl)-2-[(5-undecylpyrrol-2-ylidene)methyl]-1H-pyrrole

Structure

SMILES: CCCCCCCCCCCC1=CC=C(C=C2N=C(C3=CC=CN3)C=C2OC)N1

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InChI: InChI=1S/C25H35N3O/c1-3-4-5-6-7-8-9-10-11-13-20-15-16-21(27-20)18-24-25(29-2)19-23(28-24)22-14-12-17-26-22/h12,14-19,26-27H,3-11,13H2,1-2H3

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InChIKey: HIYSWASSDOXZLC-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 393.5750000000001

TPSA: 53.17

MolLogP: 6.790200000000008

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information