Desferri-peucechelin

AlkaPlorer ID: AK066017

Synonym: None

IUPAC Name: (2R)-2-[[(2S)-2-acetamido-5-[formyl(hydroxy)amino]pentanoyl]amino]-5-(diaminomethylideneamino)-N-[3-[(2S,5S)-5-[3-[formyl(hydroxy)amino]propyl]-3,6-dioxopiperazin-2-yl]propyl]-N-hydroxypentanamide

Structure

SMILES: CC(O)=N[C@@H](CCCN(O)C=O)C(O)=N[C@H](CCCNC(=N)N)C(=O)N(O)CCC[C@@H]1N=C(O)[C@H](CCCN(O)C=O)N=C1O

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InChI: InChI=1S/C25H44N10O10/c1-16(38)29-17(7-3-11-33(43)14-36)21(39)32-20(6-2-10-28-25(26)27)24(42)35(45)13-5-9-19-23(41)30-18(22(40)31-19)8-4-12-34(44)15-37/h14-15,17-20,43-45H,2-13H2,1H3,(H,29,38)(H,30,41)(H,31,40)(H,32,39)(H4,26,27,28)/t17-,18-,19-,20+/m0/s1

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InChIKey: IFMRYYCIFWWPAK-LWYYNNOASA-N

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Source

Properties Information

Molecule Weight: 644.6870000000002

TPSA: 313.88

MolLogP: -0.1628299999999927

Number of H-Donors: 10

Number of H-Acceptors: 11

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information