(Q105109775)

English

3-(9-{5-[(1R,4R)-4-{5-[(1R)-1,5-dihydroxyundecyl]oxolan-2-yl}-1,4-dihydroxybutyl]oxolan-2-yl}nonyl)-5-methyl-5H-furan-2-one

group of stereoisomers with the chemical formula C₃₇H₆₆O₈

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Statements

group of stereoisomers

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chemical compound

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638.475769072 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₃₇H₆₆O₈

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canonical SMILES

O=C1OC(C=C1CCCCCCCCCC2OC(CC2)C(O)CCC(O)C3OC(CC3)C(O)CCCC(O)CCCCCC)C

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isomeric SMILES

CCCCCCC(O)CCC[C@@H](O)C1CCC([C@H](O)CC[C@@H](O)C2CCC(CCCCCCCCCC3=CC(C)OC3=O)O2)O1

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Identifiers

InChI=1S/C37H66O8/c1-3-4-5-12-16-29(38)17-14-19-31(39)35-24-25-36(45-35)33(41)22-21-32(40)34-23-20-30(44-34)18-13-10-8-6-7-9-11-15-28-26-27(2)43-37(28)42/h26-27,29-36,38-41H,3-25H2,1-2H3/t27?,29?,30?,31-,32-,33-,34?,35?,36?/m1/s1

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HKIHGTSLUYNNHM-FDHXRHCCSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

HKIHGTSLUYNNHM-FDHXRHCCSA-N

UniChem compound ID

1 reference

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