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Substance Name: Ac-Ser-Gln-Asn-(3RS,4S)AHPPA-Val-Val-NH2
RN: 121822-36-4
InChIKey: CTTPVWDRGFVKIF-FFAIYHOFSA-N

Molecular Formula

  • C35-H55-N9-O11

Molecular Weight

  • 777.8715
 
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Names and Synonyms

Results Name

  • Ac-Ser-Gln-Asn-(3RS,4S)AHPPA-Val-Val-NH2

Synonym

  • Ac-Ser-Gln-Asn-(3RS,4S)AHPPA-Val-Val-NH2

Systematic Name

  • L-Valinamide, N-(4-((N2-(N2-(N-acetyl-L-seryl)-L-glutaminyl)-L-asparaginyl)amino)-2,4,5-trideoxy-5-phenylpentonoyl)-L-valyl-

Registry Numbers

CAS Registry Number

  • 121822-36-4

System Generated Number

  • 0121822364

Structure Descriptors

InChI

1S/C35H55N9O11/c1-17(2)29(31(38)51)44-35(55)30(18(3)4)43-28(50)15-25(47)22(13-20-9-7-6-8-10-20)41-33(53)23(14-27(37)49)42-32(52)21(11-12-26(36)48)40-34(54)24(16-45)39-19(5)46/h6-10,17-18,21-25,29-30,45,47H,11-16H2,1-5H3,(H2,36,48)(H2,37,49)(H2,38,51)(H,39,46)(H,40,54)(H,41,53)(H,42,52)(H,43,50)(H,44,55)/t21-,22-,23-,24-,25?,29-,30-/m0/s1

InChIKey

CTTPVWDRGFVKIF-FFAIYHOFSA-N

Smiles

CC(C)[C@@H](C(=O)N)NC(=O)[C@H](C(C)C)NC(=O)CC([C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CO)NC(=O)C)O