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1,2,6a,6b,9,9,12a-heptamethyl-10-oxidanyl-2,3,4,5,6,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-4a-carboxylic acid
1,2,6a,6b,9,9,12a-heptamethyl-10-oxidanyl-2,3,4,5,6,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-4a-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
CC1CCC2(CCC3(C(=CC=C4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O
Isomeric SMILES
CC1CCC2(CCC3(C(=CC=C4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O
InChI
InChI=1S/C30H46O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8-9,18-19,21,23-24,31H,10-17H2,1-7H3,(H,32,33)
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- [(2R,3R,4R,5R,6S)-2-[[(2R,3S,4S,5R,6S)-6-[(2R,3R,4R,5S,6S)-2-[(2Z,6E,10E,14S)-14-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4,5-bis(oxidanyl)oxan-2-yl]oxy-2,6,10,14-tetramethyl-hexadeca-2,6,10,15-tetraenoxy]-6-methyl-3,5-bis(oxidanyl)oxan-4-yl]oxy-3,4,5-tris(oxidanyl)oxan-2-yl]methoxy]-6-methyl-4,5-bis(oxidanyl)oxan-3-yl] (2E,6E,10E,14S)-14-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]
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