Benzyl [19-(α-L-allopyranosyloxy)-4,4-bis({3-[(3-{[5-(α-L-allopyranosyloxy)pentanoyl]amino}propyl)amino]-3-oxopropoxy}methyl)-2,9,15-trioxo-6-oxa-3,10,14-triazanonadec-1-yl]carbamate

More details:

• Systematic name

  benzyl N-[2-oxo-2-[[2-[3-oxo-3-[3-[5-[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxypentanoylamino]propylamino]propoxy]-1,1-bis[[3-oxo-3-[3-[5-[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxypentanoylamino]propylamino]propoxy]methyl]ethyl]amino]ethyl]carbamate

• SMILES

  c1ccc(cc1)COC(=O)NCC(=O)NC(COCCC(=O)NCCCNC(=O)CCCCO[C@H]2[C@H]([C@H]([C@H]([C@@H](O2)CO)O)O)O)(COCCC(=O)NCCCNC(=O)CCCCO[C@H]3[C@H]([C@H]([C@H]([C@@H](O3)CO)O)O)O)COCCC(=O)NCCCNC(=O)CCCCO[C@H]4[C@H]([C@H]([C@H]([C@@H](O4)CO)O)O)O

• Std. InChi

  InChI=1S/C65H110N8O30/c74-34-42-52(84)55(87)58(90)61(101-42)97-27-7-4-15-45(77)66-21-10-24-69-48(80)18-30-94-38-65(73-51(83)33-72-64(93)100-37-41-13-2-1-3-14-41,39-95-31-19-49(81)70-25-11-22-67-46(78)16-5-8-28-98-62-59(91)56(88)53(85)43(35-75)102-62)40-96-32-20-50(82)71-26-12-23-68-47(79)17-6-9-29-99-63-60(92)57(89)54(86)44(36-76)103-63/h1-3,13-14,42-44,52-63,74-76,84-92H,4-12,15-40H2,(H,66,77)(H,67,78)(H,68,79)(H,69,80)(H,70,81)(H,71,82)(H,72,93)(H,73,83)/t42-,43-,44-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61+,62+,63+/m0/s1

• Std. InChIKey

  QHUCVGSGKQHADW-JIMFVPRVSA-N

• Cite this record

  CSID:30845013, http://www.chemspider.com/Chemical-Structure.30845013.html (accessed 14:04, Apr 25, 2024)