Chem
J-GLOBAL ID：200907087828591000   Nikkaji number：J1.679.932G

JMV-509

Boc-L-Lys-L-Lys-L-Pro-N-(2-ナフチルアミノ)-D-Ile-L-Leu-OH
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C44H70N8O8
Molecular formula furigana： C44-H70-N8-O8
Molecular weight： 839.092
InChI： InChI=1S/C44H70N8O8/c1-8-29(4)37(39(54)48-35(42(57)58)26-28(2)3)52(50-32-22-21-30-16-9-10-17-31(30)27-32)41(56)36-20-15-25-51(36)40(55)34(19-12-14-24-46)47-38(53)33(18-11-13-23-45)49-43(59)60-44(5,6)7/h9-10,16-17,21-22,27-29,33-37,50H,8,11-15,18-20,23-26,45-46H2,1-7H3,(H,47,53)(H,48,54)(H,49,59)(H,57,58)/t29-,33+,34+,35+,36+,37-/m1/s1
InChI key： IAWRTWUAOZUMQF-WIGBAWJRSA-N
SMILES： CC[C@@H](C)[C@@H](N(Nc1ccc2ccccc2c1)C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O
Systematic name  (3)：
  • Boc-L-Lys-L-Lys-L-Pro-N-(2-ナフチルアミノ)-D-Ile-L-Leu-OH
  • (2S)-2-[(2R,3R)-2-{1-[(2S)-1-[(2S)-6-アミノ-2-[(2S)-6-アミノ-2-{[(tert-ブトキシ)カルボニル]アミノ}ヘキサンアミド]ヘキサノイル]ピロリジン-2-イル]-N-[(ナフタレン-2-イル)アミノ]ホルムアミド}-3-メチルペンタンアミド]-4-メチルペンタン酸
  • (2S)-2-[(2R,3R)-2-{1-[(2S)-1-[(2S)-6-amino-2-[(2S)-6-amino-2-{[(tert-butoxy)carbonyl]amino}hexanamido]hexanoyl]pyrrolidin-2-yl]-N-[(naphthalen-2-yl)amino]formamido}-3-methylpentanamido]-4-methylpentanoic acid
Other name (2)：
  • Boc-L-Lys-L-Lys-L-Pro-N-(2-Naphthylamino)-D-Ile-L-Leu-OH
  • JMV-509
Thsaurus map：
Thesaurus Map

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