(Q105124655)

English

[2,6,8,11,12-pentahydroxy-11-(hydroxymethyl)-3,7-dimethyl-14-oxo-4-propan-2-yl-13-oxatetracyclo[5.5.3.01,8.02,6]pentadec-3-en-5-yl] 1H-pyrrole-2-carboxylate

group of stereoisomers with the chemical formula C₂₅H₃₃NO₁₀

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instance of

group of stereoisomers

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507.210446256 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₅H₃₃NO₁₀

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canonical SMILES

O=C(OC1C(=C(C)C2(O)C1(O)C3(C)CC(=O)OC42C(O)C(O)(CO)CCC43O)C(C)C)C5=CC=CN5

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Identifiers

InChI

InChI=1S/C25H33NO10/c1-12(2)16-13(3)23(33)24(34,17(16)35-18(29)14-6-5-9-26-14)20(4)10-15(28)36-25(23)19(30)21(31,11-27)7-8-22(20,25)32/h5-6,9,12,17,19,26-27,30-34H,7-8,10-11H2,1-4H3

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InChIKey

JBYNLPJMCTVJAE-UHFFFAOYSA-N

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1 reference

17 September 2022

inferred from InChIKey

(Q105124655)

[2,6,8,11,12-pentahydroxy-11-(hydroxymethyl)-3,7-dimethyl-14-oxo-4-propan-2-yl-13-oxatetracyclo[5.5.3.01,8.02,6]pentadec-3-en-5-yl] 1H-pyrrole-2-carboxylate

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