(Q104200864)

English

5-[2-(acetyloxy)-5-[(4-hydroxy-5,6-dimethyl-2-oxopyran-3-yl)methyl]-1,4a-dimethyl-6-methylidene-hexahydro-2H-naphthalen-1-yl]-2-methylpent-2-enoic acid

group of stereoisomers with the chemical formula C₂₉H₄₀O₇

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instance of

group of stereoisomers

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chemical compound

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mass

500.2774036199998 dalton

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based on heuristic

inferred from InChI

chemical formula

C₂₉H₄₀O₇

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canonical SMILES

O=C(O)C(=CCCC1(C)C(OC(=O)C)CCC2(C)C(C(=C)CCC12)CC=3C(=O)OC(=C(C3O)C)C)C

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Identifiers

InChI

InChI=1S/C29H40O7/c1-16-10-11-23-28(6,22(16)15-21-25(31)18(3)19(4)35-27(21)34)14-12-24(36-20(5)30)29(23,7)13-8-9-17(2)26(32)33/h9,22-24,31H,1,8,10-15H2,2-7H3,(H,32,33)

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InChIKey

XDFBIURKLOXORC-UHFFFAOYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

XDFBIURKLOXORC-UHFFFAOYSA-N

1 reference

(Q104200864)

5-[2-(acetyloxy)-5-[(4-hydroxy-5,6-dimethyl-2-oxopyran-3-yl)methyl]-1,4a-dimethyl-6-methylidene-hexahydro-2H-naphthalen-1-yl]-2-methylpent-2-enoic acid

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