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Substance Name: N-(N-(N-(O4-Benzyl-N-(N2-(5-oxo-L-prolyl)-L-glutaminyl)-L-alpha-aspartyl)-L-tyrosyl)-L-threonyl)-2'-((benzyloxy)carbonyl)glycinohydrazide
RN: 71488-66-9
InChIKey: WXKMTJYHODAHAR-XZHHZCFOSA-N

Molecular Formula

  • C44-H53-N9-O14

Molecular Weight

  • 931.9517
 
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Names and Synonyms

Synonym

  • EINECS 275-535-8

Systematic Name

  • N-(N-(N-(O4-Benzyl-N-(N2-(5-oxo-L-prolyl)-L-glutaminyl)-L-alpha-aspartyl)-L-tyrosyl)-L-threonyl)-2'-((benzyloxy)carbonyl)glycinohydrazide

Registry Numbers

CAS Registry Number

  • 71488-66-9

System Generated Number

  • 0071488669

Structure Descriptors

InChI

1S/C44H53N9O14/c1-25(54)38(43(64)46-22-36(58)52-53-44(65)67-24-28-10-6-3-7-11-28)51-42(63)32(20-26-12-14-29(55)15-13-26)49-41(62)33(21-37(59)66-23-27-8-4-2-5-9-27)50-40(61)31(16-18-34(45)56)48-39(60)30-17-19-35(57)47-30/h2-15,25,30-33,38,54-55H,16-24H2,1H3,(H2,45,56)(H,46,64)(H,47,57)(H,48,60)(H,49,62)(H,50,61)(H,51,63)(H,52,58)(H,53,65)/t25-,30+,31+,32+,33+,38+/m1/s1

InChIKey

WXKMTJYHODAHAR-XZHHZCFOSA-N

Smiles

C[C@H]([C@@H](C(=O)NCC(=O)NNC(=O)OCc1ccccc1)NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](CC(=O)OCc3ccccc3)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H]4CCC(=O)N4)O