Methyl (3S)-3-hydroxy-5-[(2S,4aR,5'R,6aS,7S)-2-{[(2R,3R,4S,5S,6R)-4-hydroxy-6-(hydroxymethyl)-5-{[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-3-{[(2S,3R,4R,5R,6S)- 3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-2-yl]oxy}-4a,6a,7-trimethyl-1,2,3,3',4,4',4a,4b,5,5',6,6',6a,6b,7,9a,10,10a,10b,11-icosahydrospiro[naphtho[2',1':4,5]indeno[2, 1-b]furan-8,2'-pyran]-5'-yl]-3-methyl-5-oxop

More details:

• Systematic name

  Methyl (3S)-3-hydroxy-5-[(2S,4aR,5'R,6aS,7S)-2-{[(2R,3R,4S,5S,6R)-4-hydroxy-6-(hydroxymethyl)-5-{[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-3-{[(2S,3R,4R,5R,6S)- 3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-2-yl]oxy}-4a,6a,7-trimethyl-1,2,3,3',4,4',4a,4b,5,5',6,6',6a,6b,7,9a,10,10a,10b,11-icosahydrospiro[naphtho[2',1':4,5]indeno[2, 1-b]furan-8,2'-pyran]-5'-yl]-3-methyl-5-oxopentanoate

• SMILES

  C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2O[C@H]3CC[C@@]4(C5CC[C@]6(C(C5CC=C4C3)CC7C6[C@@H](C8(O7)CC[C@H](CO8)C(=O)C[C@@](C)(CC(=O)OC)O)C)C)C)CO)O[C@@H]9[C@H]([C@@H]([C@H]([C@@H](O9)CO)O)O)O)O)O)O)O

• Std. InChi

  InChI=1S/C51H80O21/c1-22-35-31(72-51(22)14-9-24(21-65-51)30(54)17-48(3,63)18-34(55)64-6)16-29-27-8-7-25-15-26(10-12-49(25,4)28(27)11-13-50(29,35)5)67-47-44(71-45-40(60)38(58)36(56)23(2)66-45)42(62)43(33(20-53)69-47)70-46-41(61)39(59)37(57)32(19-52)68-46/h7,22-24,26-29,31-33,35-47,52-53,56-63H,8-21H2,1-6H3/t22-,23-,24+,26-,27?,28?,29?,31?,32-,33+,35?,36-,37-,38+,39+,40+,41-,42-,43+,44+,45-,46+,47+,48-,49-,50-,51?/m0/s1

• Std. InChIKey

  NHYNFCLNHVUFSK-YVPVSDKBSA-N

• Cite this record

  CSID:13091555, http://www.chemspider.com/Chemical-Structure.13091555.html (accessed 10:36, Apr 26, 2024)