1-[(3S,3'R,5R,5'S,10S,13S,14S,17S)-3-{[(2R,3R,4S,5S,6R)-6-({[(2S,3R,4S,5S)-3-{[(2S,3R,4S,5R,6R)-3-{[(2S,3R,4R)-3,4-Dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]oxy}-5-hydroxy-6-(hydroxymethyl)-4-{[ (2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-2-yl]oxy}-4,5-dihydroxytetrahydro-2H-pyran-2-yl]oxy}methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl ]oxy}-4,4-bis(hydroxymethyl)-3',10,13,14-tet

More details:

• Systematic name

  1-[(3S,3'R,5R,5'S,10S,13S,14S,17S)-3-{[(2R,3R,4S,5S,6R)-6-({[(2S,3R,4S,5S)-3-{[(2S,3R,4S,5R,6R)-3-{[(2S,3R,4R)-3,4-Dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]oxy}-5-hydroxy-6-(hydroxymethyl)-4-{[ (2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-2-yl]oxy}-4,5-dihydroxytetrahydro-2H-pyran-2-yl]oxy}methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl ]oxy}-4,4-bis(hydroxymethyl)-3',10,13,14-tetramethyl-1,2,3,4,4',5,5',6,7,10,11,12,13,14,15,16-hexadecahydro-3'H-spiro[cyclopenta[a]phenanthrene-17,2'-furan]-5'-yl]-1-propanone

• SMILES

  O=C(CC)[C@H]%10O[C@@]1(CC[C@]2(\C9=C(/CC[C@]12C)[C@@]8(C)CC[C@H](O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)CO[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H]6O[C@@H]5OC[C@](O)(CO)[C@H]5O)C(CO)(CO)[C@@H]8CC9)C)[C@H](C)C%10

• Std. InChi

  InChI=1S/C57H92O28/c1-6-27(63)29-15-24(2)57(85-29)14-13-53(4)26-7-8-33-52(3,25(26)9-12-54(53,57)5)11-10-34(55(33,20-60)21-61)81-47-41(71)40(70)37(67)32(80-47)19-76-49-44(35(65)28(64)18-75-49)83-50-45(84-51-46(73)56(74,22-62)23-77-51)43(38(68)31(17-59)79-50)82-48-42(72)39(69)36(66)30(16-58)78-48/h24,28-51,58-62,64-74H,6-23H2,1-5H3/t24-,28+,29+,30-,31-,32-,33-,34+,35+,36-,37-,38-,39+,40+,41-,42-,43+,44-,45-,46+,47+,48+,49+,50+,51+,52-,53+,54+,56-,57+/m1/s1

• Std. InChIKey

  STUSSGHYJCFKMG-YUCBYBRBSA-N

• Cite this record

  CSID:9030563, http://www.chemspider.com/Chemical-Structure.9030563.html (accessed 19:22, Apr 26, 2024)