SpectraBase Compound ID | 3TPqYLNkxle |
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InChI | InChI=1S/C68H94N6O22P2/c1-45(2)93-97(85,94-46(3)4)61(73-55(75)35-33-53(63(81)87-41-49-25-17-13-18-26-49)71-65(83)89-43-51-29-21-15-22-30-51)59(79)69-39-57(77)91-67(9,10)37-38-68(11,12)92-58(78)40-70-60(80)62(98(86,95-47(5)6)96-48(7)8)74-56(76)36-34-54(64(82)88-42-50-27-19-14-20-28-50)72-66(84)90-44-52-31-23-16-24-32-52/h13-32,45-48,53-54,61-62H,33-44H2,1-12H3,(H,69,79)(H,70,80)(H,71,83)(H,72,84)(H,73,75)(H,74,76) |
InChIKey | ZGABCEWNSLKFFB-UHFFFAOYSA-N |
Mol Weight | 1409.5 g/mol |
Molecular Formula | C68H94N6O22P2 |
Exact Mass | 1408.589643 g/mol |
SpectraBase Spectrum ID | I5jxqbn8cah |
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Name | N-[(N-BENZYLOXYCARBONYL-O(ALPHA)-BENZYL-(S)-GLUTAMOYL)-(2RS)-(+/-)-2-AMINO-(DIISOPROPOXYPHOSPHINYL)-ACETYL]-GLYCINE-TERT.-BUTYLESTER |
Compound Number | 5C |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C68H94N6O22P2 |
InChI | InChI=1S/C68H94N6O22P2/c1-45(2)93-97(85,94-46(3)4)61(73-55(75)35-33-53(63(81)87-41-49-25-17-13-18-26-49)71-65(83)89-43-51-29-21-15-22-30-51)59(79)69-39-57(77)91-67(9,10)37-38-68(11,12)92-58(78)40-70-60(80)62(98(86,95-47(5)6)96-48(7)8)74-56(76)36-34-54(64(82)88-42-50-27-19-14-20-28-50)72-66(84)90-44-52-31-23-16-24-32-52/h13-32,45-48,53-54,61-62H,33-44H2,1-12H3,(H,69,79)(H,70,80)(H,71,83)(H,72,84)(H,73,75)(H,74,76) |
InChIKey | ZGABCEWNSLKFFB-UHFFFAOYSA-N |
Literature Reference Author | T.KUNZE |
Literature Reference Citation | ARCH.PHARM.,329,503(1996) |
Literature Reference DOI | 10.1002/ardp.19963291106 |
Molecular Weight | 1409.469 g/mol |
Solvent | CDCl3 |