Pax10

AlkaPlorer ID: AK058965

Synonym: None

IUPAC Name: (3R)-N-[2-[[(2S)-5-(diaminomethylideneamino)-1-oxo-1-[[(3S,6R,9R,12S,15R)-3,6,9,12-tetrakis(4-aminobutyl)-2,5,8,11,14-pentaoxo-1,4,7,10,13-pentazacyclononadec-15-yl]amino]pentan-2-yl]amino]-2-oxoethyl]-3-hydroxyhexadecanamide

Structure

SMILES: CCCCCCCCCCCCC[C@@H](O)CC(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H]1CCCCN=C(O)[C@H](CCCCN)N=C(O)[C@@H](CCCCN)N=C(O)[C@@H](CCCCN)N=C(O)[C@H](CCCCN)N=C1O

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InChI: InChI=1S/C54H105N15O9/c1-2-3-4-5-6-7-8-9-10-11-12-24-39(70)37-46(71)63-38-47(72)64-41(30-23-36-62-54(59)60)49(74)66-45-29-17-22-35-61-48(73)40(25-13-18-31-55)65-50(75)42(26-14-19-32-56)67-51(76)43(27-15-20-33-57)68-52(77)44(69-53(45)78)28-16-21-34-58/h39-45,70H,2-38,55-58H2,1H3,(H,61,73)(H,63,71)(H,64,72)(H,65,75)(H,66,74)(H,67,76)(H,68,77)(H,69,78)(H4,59,60,62)/t39-,40+,41+,42-,43-,44+,45-/m1/s1

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InChIKey: OGEUBMFDYZFRJF-LYASGPROSA-N

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Properties Information

Molecule Weight: 1108.529999999999

TPSA: 446.93000000000006

MolLogP: 7.265270000000014

Number of H-Donors: 16

Number of H-Acceptors: 14

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information