(Q104986826)

English

2-[(3,5-dihydroxy-2-{[16-hydroxy-2,6,6,10,16-pentamethyl-17-(2-methylprop-1-en-1-yl)-19,21-dioxahexacyclo[18.2.1.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0¹⁵,²⁰]tricosan-7-yl]oxy}-6-(hydroxymethyl)oxan-4-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

group of stereoisomers with the chemical formula C₄₂H₆₈O₁₄

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

796.4609068560004 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₂H₆₈O₁₄

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canonical SMILES

OCC1OC(OC2C(O)C(OC(CO)C2O)OC3CCC4(C)C(CCC5(C)C4CCC6C7C(O)(C)C(C=C(C)C)COC87OCC65C8)C3(C)C)C(O)C(O)C1O

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Identifiers

InChI

InChI=1S/C42H68O14/c1-20(2)14-21-17-51-42-18-41(19-52-42)22(34(42)40(21,7)50)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-39(26,41)6)55-36-32(49)33(29(46)24(16-44)54-36)56-35-31(48)30(47)28(45)23(15-43)53-35/h14,21-36,43-50H,8-13,15-19H2,1-7H3

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InChIKey

DQBAJFFGCXINLY-UHFFFAOYSA-N

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PubChem CID

73030201

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based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

DQBAJFFGCXINLY-UHFFFAOYSA-N

1 reference

(Q104986826)

2-[(3,5-dihydroxy-2-{[16-hydroxy-2,6,6,10,16-pentamethyl-17-(2-methylprop-1-en-1-yl)-19,21-dioxahexacyclo[18.2.1.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0¹⁵,²⁰]tricosan-7-yl]oxy}-6-(hydroxymethyl)oxan-4-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

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