(Q105031281)

English

Methyl 3-[9-acetyloxy-7-(furan-3-yl)-13,17-dihydroxy-1,8,12,15,15-pentamethyl-5,14-dioxo-3,6,16-trioxapentacyclo[9.6.0.02,4.02,8.013,17]heptadecan-12-yl]prop-2-enoate

group of stereoisomers with the chemical formula C₂₉H₃₄O₁₂

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

574.205026528 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₉H₃₄O₁₂

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canonical SMILES

O=C(OC)C=CC1(C)C2CC(OC(=O)C)C3(C)C(OC(=O)C4OC43C2(C)C5(O)OC(C(=O)C51O)(C)C)C6=COC=C6

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found in taxon

Harrisonia perforata

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stated in

Chemical constituents from fruits of Harrisonia perforata

Identifiers

InChI

InChI=1S/C29H34O12/c1-14(30)38-17-12-16-24(4,10-8-18(31)36-7)27(34)22(33)23(2,3)41-29(27,35)26(16,6)28-20(40-28)21(32)39-19(25(17,28)5)15-9-11-37-13-15/h8-11,13,16-17,19-20,34-35H,12H2,1-7H3

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InChIKey

HOHMQEBYHJKCEM-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HOHMQEBYHJKCEM-UHFFFAOYSA-N

(Q105031281)

Methyl 3-[9-acetyloxy-7-(furan-3-yl)-13,17-dihydroxy-1,8,12,15,15-pentamethyl-5,14-dioxo-3,6,16-trioxapentacyclo[9.6.0.02,4.02,8.013,17]heptadecan-12-yl]prop-2-enoate

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Identifiers

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