(1'R,2S,4'S,5S,6R,8'R,12'S,13'S,20'R,21'R,24'S)-21',24'-Dihydroxy-6-isopropyl-5,11',13',22'-tetramethyl-2'-oxo-5,6-dihydrospiro[pyran-2,6'-[3,7,19]trioxatetracyclo[15.6.1.1^4,8.0^20,24]pentacosa[10, 14,16,22]tetraen]-12'-yl 4-O-{4-[acetyl(methyl)amino]-2,4,6-trideoxy-3-O-methyl-α-L-lyxo-hexopyranosyl}-2,6-dideoxy-3-O-methyl-α-L-arabino-hexopyranoside

More details:

• Systematic name

  (1'R,2S,4'S,5S,6R,8'R,12'S,13'S,20'R,21'R,24'S)-21',24'-Dihydroxy-6-isopropyl-5,11',13',22'-tetramethyl-2'-oxo-5,6-dihydrospiro[pyran-2,6'-[3,7,19]trioxatetracyclo[15.6.1.1~4,8~.0~20,24~]pentacosa[10, 14,16,22]tetraen]-12'-yl 4-O-{4-[acetyl(methyl)amino]-2,4,6-trideoxy-3-O-methyl-alpha-L-lyxo-hexopyranosyl}-2,6-dideoxy-3-O-methyl-alpha-L-arabino-hexopyranoside

• SMILES

  O=C(N(C)[C@H]1[C@@H](OC)C[C@@H](O[C@H]1C)O[C@@H]2[C@@H](OC)C[C@@H](O[C@H]2C)O[C@@H]4C(=C/C[C@H]7O[C@]/3(O[C@H](C(C)C)[C@H](\C=C\3)C)C[C@@H](OC(=O)[C@@H]5/C=C(/C)[C@@H](O)[C@H]6OCC(=C\C=C\[C@@H]4C)/[C@@]56O)C7)/C)C

• Std. InChi

  InChI=1S/C50H75NO14/c1-26(2)44-29(5)18-19-49(65-44)24-36-21-35(64-49)17-16-28(4)45(27(3)14-13-15-34-25-58-47-43(53)30(6)20-37(48(54)61-36)50(34,47)55)62-41-23-39(57-12)46(32(8)60-41)63-40-22-38(56-11)42(31(7)59-40)51(10)33(9)52/h13-16,18-20,26-27,29,31-32,35-47,53,55H,17,21-25H2,1-12H3/b14-13+,28-16+,34-15-/t27-,29-,31-,32-,35+,36-,37-,38-,39-,40-,41-,42+,43+,44+,45-,46-,47+,49+,50+/m0/s1

• Std. InChIKey

  BCIRJZPFXSREBG-LJFHZSAPSA-N

• Cite this record

  CSID:9797070, http://www.chemspider.com/Chemical-Structure.9797070.html (accessed 10:01, May 4, 2024)