(Q103816326)

English

2-[[2-(7-Carboxyheptyl)-10-hydroxy-6-methoxy-7-methyl-3-oxo-1,4,8-trioxaspiro[4.5]decan-9-yl]oxymethyl]-5-methyl-13-propan-2-yltetracyclo[7.4.0.02,11.04,8]tridec-12-ene-1,9-dicarboxylic acid

group of stereoisomers with the chemical formula C₃₇H₅₄O₁₃

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

706.3564417880002 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₇H₅₄O₁₃

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canonical SMILES

O=C(O)CCCCCCCC1OC2(OC1=O)C(O)C(OCC34CC5C(C)CCC5C6(C(=O)O)CC4C=C(C(C)C)C63C(=O)O)OC(C)C2OC

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Identifiers

InChI

InChI=1S/C37H54O13/c1-19(2)25-15-22-16-35(32(42)43)24-14-13-20(3)23(24)17-34(22,36(25,35)33(44)45)18-47-31-28(40)37(29(46-5)21(4)48-31)49-26(30(41)50-37)11-9-7-6-8-10-12-27(38)39/h15,19-24,26,28-29,31,40H,6-14,16-18H2,1-5H3,(H,38,39)(H,42,43)(H,44,45)

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InChIKey

APMMEDCBRAXORN-UHFFFAOYSA-N

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PubChem CID

162905683

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

APMMEDCBRAXORN-UHFFFAOYSA-N

(Q103816326)

2-[[2-(7-Carboxyheptyl)-10-hydroxy-6-methoxy-7-methyl-3-oxo-1,4,8-trioxaspiro[4.5]decan-9-yl]oxymethyl]-5-methyl-13-propan-2-yltetracyclo[7.4.0.02,11.04,8]tridec-12-ene-1,9-dicarboxylic acid

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