(Q105141414)

English

(4,14-Diacetyloxy-9,11-dihydroxy-10,13,16,16-tetramethyl-18-oxo-6,17-dioxapentacyclo[9.4.3.01,12.03,10.04,7]octadec-12-en-2-yl) benzoate

group of stereoisomers with the chemical formula C₃₁H₃₆O₁₁

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

584.225761972 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₁H₃₆O₁₁

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canonical SMILES

O=C(OC1C2C3(OC(=O)C)COC3CC(O)C2(C)C4(O)C(=O)OC(C)(C)C51C4=C(C)C(OC(=O)C)C5)C=6C=CC=CC6

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Identifiers

InChI

InChI=1S/C31H36O11/c1-15-19(39-16(2)32)13-29-22(15)31(37,26(36)42-27(29,4)5)28(6)20(34)12-21-30(14-38-21,41-17(3)33)23(28)24(29)40-25(35)18-10-8-7-9-11-18/h7-11,19-21,23-24,34,37H,12-14H2,1-6H3

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InChIKey

KIAGJENBRDLBMJ-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KIAGJENBRDLBMJ-UHFFFAOYSA-N

(Q105141414)

(4,14-Diacetyloxy-9,11-dihydroxy-10,13,16,16-tetramethyl-18-oxo-6,17-dioxapentacyclo[9.4.3.01,12.03,10.04,7]octadec-12-en-2-yl) benzoate

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