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Substance Name: Biotin - nonapeptide
RN: 115082-72-9
InChIKey: FIBWPHUPYJOTDZ-UHFFFAOYSA-N

Molecular Formula

  • C65-H95-N19-O13-S

Molecular Weight

  • 1382.65
 
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Names and Synonyms

Results Name

  • Biotin - nonapeptide

Name of Substance

  • Biotinyl-epsilon-aminohexanoyl-alanyl-arginyl-valyl-tyrosyl-isoleucyl-histidyl-prolyl-phenylalanyl(4N3)-hydroxy

Synonyms

  • Bio-epsilon-ahx-ala-arg-val-tyr-ile-his-pro-phe(4N3)-OH
  • Biotin-nonapeptide

Systematic Name

  • Angiotensin II, 1-(N-(6-((5-(hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)-1-oxohexyl)-L-alanine)-5-L-isoleucine-8-(4-azido-L-phenylalanine)-, (3aS-(3aalpha,4beta,6aalpha))-

Registry Numbers

CAS Registry Number

  • 115082-72-9

System Generated Number

  • 0115082729

Structure Descriptors

InChI

1S/C65H95N19O13S/c1-6-37(4)54(61(93)76-46(32-42-33-69-35-72-42)62(94)84-29-13-15-49(84)59(91)77-47(63(95)96)31-39-19-23-41(24-20-39)82-83-68)80-58(90)45(30-40-21-25-43(85)26-22-40)75-60(92)53(36(2)3)79-57(89)44(14-12-28-71-64(66)67)74-56(88)38(5)73-52(87)18-8-7-11-27-70-51(86)17-10-9-16-50-55-48(34-98-50)78-65(97)81-55/h19-26,33,35-38,44-50,53-55,85H,6-18,27-32,34H2,1-5H3,(H,69,72)(H,70,86)(H,73,87)(H,74,88)(H,75,92)(H,76,93)(H,77,91)(H,79,89)(H,80,90)(H,95,96)(H4,66,67,71)(H2,78,81,97)

InChIKey

FIBWPHUPYJOTDZ-UHFFFAOYSA-N

Smiles

N1([C@@H](C(N[C@@H](Cc2ccc(cc2)N=N#N)C(=O)O)=O)CCC1)C([C@@H](NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc(cc1)O)NC(=O)[C@@H](C(C)C)NC([C@@H](NC([C@@H](NC(=O)CCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2[C@@H]1NC(N2)=O)C)=O)CCCNC(N)=N)=O)[C@@H](CC)C)Cc1[nH]cnc1)=O