prezeamine

AlkaPlorer ID: AK584999

Synonym: None

IUPAC Name: 2-amino-4-[[1-[[6-(2-amino-2-oxoethyl)-3-[[4,6-dihydroxy-2-methyl-8-oxo-8-[(11,19,27,35-tetraamino-3-hydroxytetracontyl)amino]octan-3-yl]carbamoyl]-2-methyl-5,8,11-trioxo-1,4,7-triazacycloundec-9-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-4-oxobutanoic acid

Structure

SMILES: CCCCCC(N)CCCCCCCC(N)CCCCCCCC(N)CCCCCCCC(N)CCCCCCCC(O)CCN=C(O)CC(O)CC(O)C(N=C(O)C1N=C(O)C(CC(=N)O)N=C(O)C(N=C(O)C(CC2=CN=CN2)N=C(O)CC(N)C(=O)O)CC(O)=NC1C)C(C)C

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InChI: InChI=1S/C71H133N15O13/c1-5-6-19-28-49(72)29-20-11-7-12-21-30-50(73)31-22-13-8-14-23-32-51(74)33-24-15-9-16-25-34-52(75)35-26-17-10-18-27-36-54(87)37-38-79-62(91)41-55(88)40-60(89)65(47(2)3)85-70(97)66-48(4)81-64(93)44-59(68(95)83-58(43-61(77)90)69(96)86-66)84-67(94)57(39-53-45-78-46-80-53)82-63(92)42-56(76)71(98)99/h45-52,54-60,65-66,87-89H,5-44,72-76H2,1-4H3,(H2,77,90)(H,78,80)(H,79,91)(H,81,93)(H,82,92)(H,83,95)(H,84,94)(H,85,97)(H,86,96)(H,98,99)

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InChIKey: YSKPBPMQZLMBEW-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 1404.9370000000004

TPSA: 528.9800000000001

MolLogP: 10.731570000000012

Number of H-Donors: 19

Number of H-Acceptors: 18

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information