(1R)-1,5-Anhydro-2,6-dideoxy-1-[(3R,4aR,12bS)-3-{[(2S,5S,6S)-5-({2,6-dideoxy-3-O-[(2S,5S,6S)-5-({2,6-dideoxy-3-O-[(2S,5S,6S)-5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl]-β-D-arabino-hexopyranosyl}ox y)-6-methyltetrahydro-2H-pyran-2-yl]-β-D-arabino-hexopyranosyl}oxy)-6-methyltetrahydro-2H-pyran-2-yl]oxy}-4a,8,12b-trihydroxy-3-methyl-1,12-dioxo-1,3,4,4a,12,12b-hexahydro-2H-benzo[a]xanthen-9-yl]- 4-O-{(4ξ)-2,6-dideoxy-4-O-[(2S,5S,6S)-6-methyl-5-{[(2R,6S)-6-methyl-5-oxo-5,6-dihydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-2-yl]-α-L-threo-hexopyranosyl}-D-arabino-hexitol

More details:

• Systematic name

  (1R)-1,5-Anhydro-2,6-dideoxy-1-[(3R,4aR,12bS)-3-{[(2S,5S,6S)-5-({2,6-dideoxy-3-O-[(2S,5S,6S)-5-({2,6-dideoxy-3-O-[(2S,5S,6S)-5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl]-beta-D-arabino-hexopyranosyl}ox y)-6-methyltetrahydro-2H-pyran-2-yl]-beta-D-arabino-hexopyranosyl}oxy)-6-methyltetrahydro-2H-pyran-2-yl]oxy}-4a,8,12b-trihydroxy-3-methyl-1,12-dioxo-1,3,4,4a,12,12b-hexahydro-2H-benzo[a]xanthen-9-yl]- 4-O-{(4xi)-2,6-dideoxy-4-O-[(2S,5S,6S)-6-methyl-5-{[(2R,6S)-6-methyl-5-oxo-5,6-dihydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-2-yl]-alpha-L-threo-hexopyranosyl}-D-arabino-hexitol

• SMILES

  C[C@]1(C[C@@]2(O)C=CC3OC4=C(C=CC([C@H]5C[C@@H](O)[C@H](O[C@H]6C[C@H](O)C(O[C@H]7CC[C@H](O[C@H]8C=CC(=O)[C@H](C)O8)[C@H](C)O7)[C@H](C)O6)[C@@H](C)O5)=C4O)C(=O)C=3[C@@]2(O)C(=O)C1)O[C@H]1CC[C@H](O[C@H]2C[C@@H](O[C@H]3CC[C@H](O[C@H]4C[C@@H](O[C@H]5CC[C@H](O)[C@H](C)O5)[C@H](O)[C@@H](C)O4)[C@H](C)O3)[C@H](O)[C@@H](C)O2)[C@H](C)O1

• Std. InChi

  InChI=1S/C72H102O29/c1-31-42(73)13-18-54(85-31)93-46-16-21-57(88-33(46)3)99-68-39(9)92-59(26-45(68)76)100-67-38(8)84-50(25-44(67)75)40-11-12-41-65(80)62-49(98-69(41)66(40)81)23-24-71(82)30-70(10,29-53(77)72(62,71)83)101-58-22-17-48(35(5)89-58)95-61-28-52(64(79)37(7)91-61)97-56-20-15-47(34(4)87-56)94-60-27-51(63(78)36(6)90-60)96-55-19-14-43(74)32(2)86-55/h11-13,18,23-24,31-39,43-48,50-52,54-61,63-64,67-68,74-76,78-79,81-83H,14-17,19-22,25-30H2,1-10H3/t31-,32-,33-,34-,35-,36+,37+,38+,39-,43-,44+,45-,46-,47-,48-,50+,51+,52+,54-,55-,56-,57-,58-,59-,60-,61-,63+,64+,67+,68?,70-,71-,72-/m0/s1

• Std. InChIKey

  HXKIEUQACANSNK-SBCHTQRNSA-N

• Cite this record

  CSID:78436504, http://www.chemspider.com/Chemical-Structure.78436504.html (accessed 16:16, Jun 3, 2024)