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Substance Name: Butanoic acid, L-2-aminobutanoyl-L-threonyl-L-asparaginyl-L-tyrosyl-L-2-amino-
RN: 123952-14-7
InChIKey: HPEBQHGJJYECRG-KJSGDYLNSA-N

Molecular Formula

  • C25-H38-N6-O9

Molecular Weight

  • 566.6082
 
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Names and Synonyms

Synonyms

  • H-Abu-Thr-Asn-Tyr-Abu-OH
  • H-alpha-Aminobutyric acid-Thr-Asn-Tyr-alpha-Aminobutyric acid-OH

Systematic Name

  • Butanoic acid, L-2-aminobutanoyl-L-threonyl-L-asparaginyl-L-tyrosyl-L-2-amino-

Registry Numbers

CAS Registry Number

  • 123952-14-7

System Generated Number

  • 0123952147

Structure Descriptors

InChI

1S/C25H38N6O9/c1-4-15(26)21(35)31-20(12(3)32)24(38)30-18(11-19(27)34)23(37)29-17(10-13-6-8-14(33)9-7-13)22(36)28-16(5-2)25(39)40/h6-9,12,15-18,20,32-33H,4-5,10-11,26H2,1-3H3,(H2,27,34)(H,28,36)(H,29,37)(H,30,38)(H,31,35)(H,39,40)/t12-,15+,16+,17+,18+,20+/m1/s1

InChIKey

HPEBQHGJJYECRG-KJSGDYLNSA-N

Smiles

CC[C@@H](C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](Cc1ccc(cc1)O)C(=O)N[C@@H](CC)C(=O)O)N