(2R,3R,4R,6S)-6-{[(2R,3aR,4R,4'R,5'S,6S,6'R,7S,7aR)-6-{[(2S,3R,4R,5S,6R)-2-{[(2R,3S,4S,5S,6S)-6-({(2R,3aS,3a'R,6S,7R,7'R,7aS,7a'S)-7'-[(2,4-Dihydroxy-6-methylbenzoyl)oxy]-7-hydroxyoctahydro-4H-2,4'-sp irobi[[1,3]dioxolo[4,5-c]pyran]-6-yl}oxy)-4-hydroxy-5-methoxy-2-(methoxymethyl)tetrahydro-2H-pyran-3-yl]oxy}-3-hydroxy-5-methoxy-6-methyltetrahydro-2H-pyran-4-yl]oxy}-4',7-dihydroxy-4,6',7a-trimethylo ctahydro-4H-spiro[1,3-dioxolo[4,5-c]pyran-2,

More details:

• Systematic name

  (2R,3R,4R,6S)-6-{[(2R,3aR,4R,4'R,5'S,6S,6'R,7S,7aR)-6-{[(2S,3R,4R,5S,6R)-2-{[(2R,3S,4S,5S,6S)-6-({(2R,3aS,3a'R,6S,7R,7'R,7aS,7a'S)-7'-[(2,4-Dihydroxy-6-methylbenzoyl)oxy]-7-hydroxyoctahydro-4H-2,4'-sp irobi[[1,3]dioxolo[4,5-c]pyran]-6-yl}oxy)-4-hydroxy-5-methoxy-2-(methoxymethyl)tetrahydro-2H-pyran-3-yl]oxy}-3-hydroxy-5-methoxy-6-methyltetrahydro-2H-pyran-4-yl]oxy}-4',7-dihydroxy-4,6',7a-trimethylo ctahydro-4H-spiro[1,3-dioxolo[4,5-c]pyran-2,2'-pyran]-5'-yl]oxy}-4-{[(2S,4S,5R,6S)-5-methoxy-4,6-dimethyl-4-nitrotetrahydro-2H-pyran-2-yl]oxy}-2-methyltetrahydro-2H-pyran-3-yl 3-chloro-4-hydroxy-2-met hoxy-6-methylbenzoate

• SMILES

  Cc1cc(cc(c1C(=O)O[C@@H]2CO[C@]3([C@H]4[C@H]2OCO4)O[C@H]5CO[C@H]([C@@H]([C@@H]5O3)O)O[C@H]6[C@H]([C@H]([C@@H]([C@H](O6)COC)O[C@H]7[C@@H]([C@H]([C@H]([C@H](O7)C)OC)O[C@H]8[C@H]([C@@]9([C@@H]([C@H](O8)C)O[C@@]1(O9)C[C@H]([C@@H]([C@H](O1)C)O[C@H]1C[C@H]([C@@H]([C@H](O1)C)OC(=O)c1c(cc(c(c1OC)Cl)O)C)O[C@H]1C[C@]([C@H]([C@@H](O1)C)OC)(C)[N+](=O)[O-])O)C)O)O)O)OC)O)O

• Std. InChi

  InChI=1S/C70H98ClNO38/c1-25-15-32(73)17-33(74)42(25)61(81)99-38-23-93-70(60-53(38)91-24-92-60)107-39-22-90-63(46(78)52(39)108-70)105-65-56(88-13)45(77)51(37(100-65)21-85-10)103-64-47(79)55(50(86-11)28(4)96-64)104-66-57(80)68(9)59(31(7)97-66)109-69(110-68)19-35(76)48(29(5)106-69)101-40-18-36(98-41-20-67(8,72(83)84)58(89-14)30(6)95-41)49(27(3)94-40)102-62(82)43-26(2)16-34(75)44(71)54(43)87-12/h15-17,27-31,35-41,45-53,55-60,63-66,73-80H,18-24H2,1-14H3/t27-,28-,29-,30+,31-,35-,36-,37-,38-,39+,40+,41+,45+,46-,47-,48-,49-,50+,51-,52-,53+,55-,56+,57-,58+,59-,60-,63+,64+,65+,66+,67+,68-,69-,70-/m1/s1

• Std. InChIKey

  FLUSUFZXDQYQHR-ZHWARYNPSA-N

• Cite this record

  CSID:24686497, http://www.chemspider.com/Chemical-Structure.24686497.html (accessed 21:35, Jun 28, 2024)