(Q104913519)

English

[9-Acetyloxy-6-(furan-3-yl)-13-hydroxy-16-(1-hydroxy-2-methoxy-2-oxoethyl)-1,5,15,15-tetramethyl-12-(2-methylpropanoyloxy)-8,17-dioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-10-en-14-yl] 2-methylbut-2-enoate

group of stereoisomers with the chemical formula C₃₈H₄₈O₁₄

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

728.304406216 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₈H₄₈O₁₄

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canonical SMILES

O=C(OC1C2(O)C(=O)C(C)(C3C(=C4C(OC(=O)C)C(=O)OC(C5=COC=C5)C4(C)CC3)C2OC(=O)C(C)C)C(C(O)C(=O)OC)C1(C)C)C(=CC)C

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Identifiers

InChI

InChI=1S/C38H48O14/c1-11-18(4)30(42)52-34-35(6,7)26(24(40)31(43)47-10)37(9)21-12-14-36(8)23(22(21)28(38(34,46)33(37)45)51-29(41)17(2)3)25(49-19(5)39)32(44)50-27(36)20-13-15-48-16-20/h11,13,15-17,21,24-28,34,40,46H,12,14H2,1-10H3

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InChIKey

AKBCEXILHLAVQT-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

AKBCEXILHLAVQT-UHFFFAOYSA-N

(Q104913519)

[9-Acetyloxy-6-(furan-3-yl)-13-hydroxy-16-(1-hydroxy-2-methoxy-2-oxoethyl)-1,5,15,15-tetramethyl-12-(2-methylpropanoyloxy)-8,17-dioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-10-en-14-yl] 2-methylbut-2-enoate

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