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Substance Name: tert-Butyloxycarbonyl-aminoisobutyryl-valyl-aminoisobutyryl-aminoisobutyryl-valyl-valyl-valyl-aminoisobutyryl-valyl-aminoisobutyryl methyl ester
RN: 106777-22-4
InChIKey: YDLOIAXXVVOSFD-LJADHVKFSA-N

Molecular Weight

  • 1053.3448
 
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Names and Synonyms

Name of Substance

  • tert-Butyloxycarbonyl-aminoisobutyryl-valyl-aminoisobutyryl-aminoisobutyryl-valyl-valyl-valyl-aminoisobutyryl-valyl-aminoisobutyryl methyl ester

Synonyms

  • BAVAO
  • Boc-aib-val-aib-aib-val-val-val-aib-val-aib-ome

Registry Numbers

CAS Registry Number

  • 106777-22-4

System Generated Number

  • 0106777224

Structure Descriptors

InChI

1S/C51H92N10O13/c1-25(2)30(35(62)53-32(27(5)6)37(64)57-47(14,15)40(67)55-34(29(9)10)39(66)59-51(22,23)44(71)73-24)52-36(63)31(26(3)4)54-41(68)48(16,17)60-43(70)50(20,21)58-38(65)33(28(7)8)56-42(69)49(18,19)61-45(72)74-46(11,12)13/h25-34H,1-24H3,(H,52,63)(H,53,62)(H,54,68)(H,55,67)(H,56,69)(H,57,64)(H,58,65)(H,59,66)(H,60,70)(H,61,72)/t30-,31-,32-,33-,34-/m0/s1

InChIKey

YDLOIAXXVVOSFD-LJADHVKFSA-N

Smiles

CC(C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)NC(C)(C)C(=O)N[C@@H](C(C)C)C(=O)NC(C)(C)C(=O)OC)NC(=O)[C@H](C(C)C)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)[C@H](C(C)C)NC(=O)C(C)(C)NC(=O)OC(C)(C)C