(Q105374880)

English

[3,4,6,11-Tetraacetyloxy-2,8-dihydroxy-13-(hydroxymethyl)-1,15-dimethyl-9-methylidene-14-oxo-16-oxatetracyclo[10.5.0.02,15.05,10]heptadecan-5-yl]methyl benzoate

group of stereoisomers with the chemical formula C₃₆H₄₄O₁₅

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

716.727 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₆H₄₄O₁₅

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canonical SMILES

O=C(OCC12C(OC(=O)C)CC(O)C(=C)C2C(OC(=O)C)C3C(C(=O)C4(OCC3(C)C4(O)C(OC(=O)C)C1OC(=O)C)C)CO)C=5C=CC=CC5

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Identifiers

InChI

InChI=1S/C36H44O15/c1-17-24(42)13-25(48-18(2)38)35(16-46-32(44)22-11-9-8-10-12-22)26(17)28(49-19(3)39)27-23(14-37)29(43)34(7)36(45,33(27,6)15-47-34)31(51-21(5)41)30(35)50-20(4)40/h8-12,23-28,30-31,37,42,45H,1,13-16H2,2-7H3

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InChIKey

ZFXSJZPTCKIFHG-UHFFFAOYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

ZFXSJZPTCKIFHG-UHFFFAOYSA-N

1 reference

(Q105374880)

[3,4,6,11-Tetraacetyloxy-2,8-dihydroxy-13-(hydroxymethyl)-1,15-dimethyl-9-methylidene-14-oxo-16-oxatetracyclo[10.5.0.02,15.05,10]heptadecan-5-yl]methyl benzoate

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