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

PropertiesImageOccurences in reactions
MNX_IDMNXM1383332Image of MNXM1383332
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC41H64O15
charge0
mass796.948
referencechebi:181990
InChIKeyXMIDHJQDTWKJIZ-ZEMGKMIXSA-N
InChIInChI=1S/C41H64O15/c1-36(18-43)10-12-41(35(52)56-34-31(51)29(49)28(48)24(16-42)54-34)13-11-39(4)20(21(41)14-36)6-7-26-37(2)15-22(45)32(55-33-30(50)27(47)23(46)17-53-33)38(3,19-44)25(37)8-9-40(26,39)5/h6,18,21-34,42,44-51H,7-17,19H2,1-5H3/t21?,22-,23+,24+,25?,26?,27-,28+,29-,30+,31+,32-,33-,34-,36?,37-,38-,39+,40+,41-/m0/s1
SMILES[CH3:1][C:36]1([CH:18]=[O:43])[CH2:10][CH2:12][C@:41]2([C:35](=[O:52])[O:56][C@H:34]3[C@H:31]([OH:51])[C@@H:29]([OH:49])[C@H:28]([OH:48])[C@@H:24]([CH2:16][OH:42])[O:54]3)[CH2:13][CH2:11][C@:39]3([CH3:4])[C:20](=[CH:6][CH2:7][CH:26]4[C@@:37]5([CH3:2])[CH2:15][C@H:22]([OH:45])[C@H:32]([O:55][C@H:33]6[C@H:30]([OH:50])[C@@H:27]([OH:47])[C@H:23]([OH:46])[CH2:17][O:53]6)[C@@:38]([CH3:3])([CH2:19][OH:44])[CH:25]5[CH2:8][CH2:9][C@:40]43[CH3:5])[CH:21]2[CH2:14]1
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IdentifierDescription
CHEBI:181990
chebi:181990 		[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (4aR,6aS,6bR,9R,10R,11S,12aR)-2-formyl-11-hydroxy-9-(hydroxymethyl)-2,6a,6b,9,12a-pentamethyl-10-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (4aR,6aS,6bR,9R,10R,11S,12aR)-2-ormyl-11-hydroxy-9-(hydroxymethyl)-2,6a,6b,9,12a-pentamethyl-10-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate