(1'R,2S,2'S,4R,4a'S,6a'R,6b'R,7'R,10a'R,11a'R,13a'R)-2'-{[(2R,3S,4R,5S,6R)-6-{[(2S,3S,4S,5S)-3-{[(2S,3S,4S,5S,6S)-4,5-Dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methyltetrahyd ro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-2-yl]oxy}-4,5-dihydroxytetrahydro-2H-pyran-2-yl]oxy}-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl]oxy}-1'-(hydroxymethyl)-1',4,4a',6a',7',11a'-hexamethyl-2',3,3',4 ,4',4a',5',6',6a',6b',7',8',10a',11',11a',12',13',13a'-octadecahydro-1'H,5H-spiro[furan-2,9'-naphtho[2',1':4,5]indeno[2,1-b]pyran]-5-one (non-preferred name)

More details:

• Systematic name

  (1'R,2S,2'S,4R,4a'S,6a'R,6b'R,7'R,10a'R,11a'R,13a'R)-2'-{[(2R,3S,4R,5S,6R)-6-{[(2S,3S,4S,5S)-3-{[(2S,3S,4S,5S,6S)-4,5-Dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methyltetrahyd ro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-2-yl]oxy}-4,5-dihydroxytetrahydro-2H-pyran-2-yl]oxy}-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl]oxy}-1'-(hydroxymethyl)-1',4,4a',6a',7',11a'-hexamethyl-2',3,3',4 ,4',4a',5',6',6a',6b',7',8',10a',11',11a',12',13',13a'-octadecahydro-1'H,5H-spiro[furan-2,9'-naphtho[2',1':4,5]indeno[2,1-b]pyran]-5-one (non-preferred name)

• SMILES

  C[C@@H]1C[C@]2(C[C@H](C(=O)O2)C)O[C@H]3[C@H]1[C@]4(CCC5=C([C@@]4(C3)C)CC[C@@H]6[C@@]5(CC[C@@H]([C@@]6(C)CO)O[C@H]7[C@H]([C@H]([C@@H]([C@@H](O7)O[C@H]8[C@H]([C@H]([C@H](CO8)O)O)O[C@H]9[C@H]([C@H]([C@@H]([C@@H](O9)CO)O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C)O)O)O)O)O)O)C)C

• Std. InChi

  InChI=1S/C52H82O23/c1-20-14-52(15-21(2)42(65)75-52)74-26-16-51(7)24-8-9-28-48(4,23(24)10-13-50(51,6)30(20)26)12-11-29(49(28,5)19-54)69-44-38(63)35(60)39(64)45(72-44)73-46-40(32(57)25(55)18-66-46)71-47-41(36(61)33(58)27(17-53)68-47)70-43-37(62)34(59)31(56)22(3)67-43/h20-22,25-41,43-47,53-64H,8-19H2,1-7H3/t20-,21-,22+,25+,26-,27+,28-,29+,30+,31+,32+,33-,34+,35-,36+,37-,38+,39+,40+,41+,43+,44-,45+,46+,47+,48-,49+,50-,51+,52+/m1/s1

• Std. InChIKey

  QEGKMWVVMVDUNZ-UJZXRNIJSA-N

• Cite this record

  CSID:34229625, http://www.chemspider.com/Chemical-Structure.34229625.html (accessed 13:46, Apr 24, 2024)