(Q104908338)

English

2-[[6-[[1,6-Dihydroxy-3a-(hydroxymethyl)-5a,8,8,11a,13a-pentamethyl-3-propan-2-yl-1,2,3,4,5,5b,6,7,7a,9,10,11,13,13b-tetradecahydrocyclopenta[a]chrysen-9-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

group of stereoisomers with the chemical formula C₄₂H₇₀O₁₄

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instance of

group of stereoisomers

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1 reference

798.47655692 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₄₂H₇₀O₁₄

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canonical SMILES

OCC1OC(OCC2OC(OC3CCC4(C5=CCC6(C)C7C(O)CC(C(C)C)C7(CO)CCC6(C)C5C(O)CC4C3(C)C)C)C(O)C(O)C2O)C(O)C(O)C1O

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Identifiers

InChI

InChI=1S/C42H70O14/c1-19(2)21-14-23(46)35-41(7)11-8-20-28(40(41,6)12-13-42(21,35)18-44)22(45)15-26-38(3,4)27(9-10-39(20,26)5)56-37-34(52)32(50)30(48)25(55-37)17-53-36-33(51)31(49)29(47)24(16-43)54-36/h8,19,21-37,43-52H,9-18H2,1-7H3

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InChIKey

AASNWSYGBVDYSL-UHFFFAOYSA-N

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1 reference

17 September 2022

inferred from InChIKey

(Q104908338)

2-[[6-[[1,6-Dihydroxy-3a-(hydroxymethyl)-5a,8,8,11a,13a-pentamethyl-3-propan-2-yl-1,2,3,4,5,5b,6,7,7a,9,10,11,13,13b-tetradecahydrocyclopenta[a]chrysen-9-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

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