Chemical Compound

(2S,3S,4R)-N-[(3S,4R,7R,10R,13S,16S,19R,25aS)-10-(3-carbamimidamidopropyl)-16-(2-carbamoylethyl)-7-[(1S)-1-hydroxyethyl]-19-[(R)-(4-hydroxyphenyl)(methoxy)methyl]-3,15-dimethyl-13-(2-methylpropyl)-1,5,8,11,14,17,20-heptaoxo-tetracosahydropyrido[2,1-c]1-oxa-4,7,10,13,16,19-hexaazacyclodocosan-4-yl]-2-[(2R,3R,4S)-7-carbamimidamido-2,3-dihydroxy-4-[(2R)-2-[(2R,3R,4R)-3-hydroxy-2,4,6-trimethylheptanamido]propanamido]heptanamido]-3,4-dimethylpentanediamide

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(2S,3S,4R)-N-[(3S,4R,7R,10R,13S,16S,19R,25aS)-10-(3-carbamimidamidopropyl)-16-(2-carbamoylethyl)-7-[(1S)-1-hydroxyethyl]-19-[(R)-(4-hydroxyphenyl)(methoxy)methyl]-3,15-dimethyl-13-(2-methylpropyl)-1,5,8,11,14,17,20-heptaoxo-tetracosahydropyrido[2,1-c]1-oxa-4,7,10,13,16,19-hexaazacyclodocosan-4-yl]-2-[(2R,3R,4S)-7-carbamimidamido-2,3-dihydroxy-4-[(2R)-2-[(2R,3R,4R)-3-hydroxy-2,4,6-trimethylheptanamido]propanamido]heptanamido]-3,4-dimethylpentanediamide 结构式
Primary record

(2S,3S,4R)-N-[(3S,4R,7R,10R,13S,16S,19R,25aS)-10-(3-carbamimidamidopropyl)-16-(2-carbamoylethyl)-7-[(1S)-1-hydroxyethyl]-19-[(R)-(4-hydroxyphenyl)(methoxy)methyl]-3,15-dimethyl-13-(2-methylpropyl)-1,5,8,11,14,17,20-heptaoxo-tetracosahydropyrido[2,1-c]1-oxa-4,7,10,13,16,19-hexaazacyclodocosan-4-yl]-2-[(2R,3R,4S)-7-carbamimidamido-2,3-dihydroxy-4-[(2R)-2-[(2R,3R,4R)-3-hydroxy-2,4,6-trimethylheptanamido]propanamido]heptanamido]-3,4-dimethylpentanediamide

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177479054
SMILES
C[C@H]1[C@H](C(=O)NC(C(=O)N[C@@H](C(=O)NC(C(=O)N(C(C(=O)N[C@@H](C(=O)N2CCCC[C@H]2C(=O)O1)[C@@H](C3=CC=C(C=C3)O)OC)CCC(=O)N)C)CC(C)C)CCCN=C(N)N)[C@H](C)O)NC(=O)[C@H]([C@@H](C)[C@@H](C)C(=O)N)NC(=O)[C@@H]([C@@H]([C@H](CCCN=C(N)N)NC(=O)[C@@H](C)NC(=O)[C@H](C)[C@@H]([C@H](C)CC(C)C)O)O)O
Canonical SMILES
CO[C@H](c1ccc(O)cc1)[C@H]1NC(=O)C(CCC(N)=O)N(C)C(=O)C(CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)C([C@H](C)O)NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](O)[C@H](O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](C)NC(=O)[C@H](C)[C@H](O)[C@H](C)CC(C)C)[C@@H](C)[C@@H](C)C(N)=O)[C@H](C)OC(=O)[C@@H]2CCCCN2C1=O

名称与同义词

  • Callipeltin N
  • J3.607.499J
  • (2S,3S,4R)-N-[(3S,4R,7R,10R,13S,16S,19R,25aS)-10-(3-carbamimidamidopropyl)-16-(2-carbamoylethyl)-7-[(1S)-1-hydroxyethyl]-19-[(R)-(4-hydroxyphenyl)(methoxy)methyl]-3,15-dimethyl-13-(2-methylpropyl)-1,5,8,11,14,17,20-heptaoxo-tetracosahydropyrido[2,1-c]1-oxa-4,7,10,13,16,19-hexaazacyclodocosan-4-yl]-2-[(2R,3R,4S)-7-carbamimidamido-2,3-dihydroxy-4-[(2R)-2-[(2R,3R,4R)-3-hydroxy-2,4,6-trimethylheptanamido]propanamido]heptanamido]-3,4-dimethylpentanediamide
  • N-[(2S,3S,4R)-2-[[(2R,3R,4S)-2,3-Dihydroxy-4-[[(2R)-2-[[(2R,3R,4R)-2,4,6-trimethyl-3-hydroxy-1-oxoheptyl]amino]-1-oxopropyl]amino]-7-guanidino-1-oxoheptyl]amino]-3-methyl-4-carbamoyl-1-oxopentyl]cyclo[D-Thr*-D-Thr-D-Arg-L-Leu-N2-methyl-L-Gln-[(betaR)-beta-methoxy-D-Tyr-]-L-Pip-]