6-deoxy-l-mannopyranosyl-(1->6)-[d-lyxopyranosyl-(1->3)-d-lyxopyranosyl-(1->3)-6-deoxy-l-mannopyranosyl-(1->2)]-1-o-((3.beta.,16.alpha.)-16-hydroxy-28-oxo-3-{[.beta.-d-xylopyranosyl-(1->2)-.alpha.-d-threo-pentopyranosyl-(1->6)-.beta.-d-glucopyranosyl]oxy}olean-12-en-28-yl)-.beta.-d-glucopyranose

Structural Information

Molecular Formula

C₇₄H₁₂₀O₃₈

SMILES

C[C@H]1[C@@H]([C@H]([C@H](C(O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC(=O)[C@]34CCC(CC3C5=CC[C@@H]6[C@]7(CC[C@@H](C([C@@H]7CC[C@]6([C@@]5(C[C@H]4O)C)C)(C)C)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO[C@@H]9[C@H](C([C@@H](CO9)O)O)O[C@H]1[C@@H]([C@H]([C@@H](CO1)O)O)O)O)O)O)C)(C)C)OC1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)OC1[C@H]([C@H]([C@@H](CO1)O)OC1[C@H]([C@H]([C@@H](CO1)O)O)O)O)O)O)O)O)O)O

InChI

InChI=1S/C74H120O38/c1-26-40(80)47(87)52(92)60(103-26)101-24-35-46(86)49(89)59(111-65-55(95)57(41(81)27(2)104-65)109-63-54(94)56(33(78)23-99-63)108-61-50(90)42(82)30(75)20-97-61)67(106-35)112-68(96)74-17-16-69(3,4)18-29(74)28-10-11-37-71(7)14-13-39(70(5,6)36(71)12-15-72(37,8)73(28,9)19-38(74)79)107-64-53(93)48(88)45(85)34(105-64)25-102-66-58(44(84)32(77)22-100-66)110-62-51(91)43(83)31(76)21-98-62/h10,26-27,29-67,75-95H,11-25H2,1-9H3/t26-,27-,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-,55+,56-,57+,58-,59+,60?,61?,62-,63?,64-,65?,66+,67-,71-,72+,73+,74+/m0/s1

InChIKey

CYICFWSYZHXHCH-UHBOTICTSA-N

Compound name

[(2S,3R,4S,5S,6R)-3-[(3R,4R,5S,6S)-4-[(3S,4S,5R)-3,5-dihydroxy-4-[(3S,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,5-dihydroxy-6-methyloxan-2-yl]oxy-4,5-dihydroxy-6-[[(3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR)-10-[(2R,3R,4S,5S,6R)-6-[[(2R,3S,5R)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate

Related CIDs

• CID 476862