(Q105237435)

English

(2R)-4-[(11S)-11-hydroxy-11-[(2S,5R)-5-[(1S)-1-hydroxyheptadecyl]oxolan-2-yl]undecyl]-2-methyl-2H-furan-5-one

chemical compound

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instance of

type of chemical entity

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1 reference

592.506675276 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(5S)-3-[(11S)-11-Hydroxy-11-[(2S,5R)-tetrahydro-5-[(1R)-1-hydroxyheptadecyl]-2-furanyl]undecyl]-5-methyl-2(5H)-furanone

1 reference

based on heuristic

inferred from InChI

(2R)-4-[(11R)-11-hydroxy-11-[(2R,5S)-5-[(1S)-1-hydroxyheptadecyl]oxolan-2-yl]undecyl]-2-methyl-2H-furan-5-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₇H₆₈O₅

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canonical SMILES

O=C1OC(C=C1CCCCCCCCCCC(O)C2OC(CC2)C(O)CCCCCCCCCCCCCCCC)C

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isomeric SMILES

CCCCCCCCCCCCCCCC[C@H](O)[C@H]1CC[C@@H]([C@@H](O)CCCCCCCCCCC2=C[C@@H](C)OC2=O)O1

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found in taxon

Annona bullata

1 reference

stated in

Natural acetogenins from annonaceae, synthesis and mechanisms of action

Identifiers

InChI

InChI=1S/C37H68O5/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-23-26-33(38)35-28-29-36(42-35)34(39)27-24-21-18-15-14-16-19-22-25-32-30-31(2)41-37(32)40/h30-31,33-36,38-39H,3-29H2,1-2H3/t31-,33+,34+,35-,36+/m1/s1

0 references

InChIKey

RJFLREBFQAUBLY-JSLQOGGJSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105237435)

(2R)-4-[(11S)-11-hydroxy-11-[(2S,5R)-5-[(1S)-1-hydroxyheptadecyl]oxolan-2-yl]undecyl]-2-methyl-2H-furan-5-one

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