(Q105217636)

English

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

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

578.454639704 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

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

2 references

based on heuristic

inferred from InChIKey

1 reference

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

1 reference

1 reference

1 reference

C₃₅H₆₂O₆

0 references

canonical SMILES

O=C1OC(C=C1CCCCCCCCCCC(O)C2OC(CC2)C3OC(CC3)C(O)CCCCCCCCCC)C

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isomeric SMILES

CCCCCCCCCC[C@@H](O)[C@H]1CC[C@H]([C@H]2CC[C@H]([C@@H](O)CCCCCCCCCCC3=C[C@H](C)OC3=O)O2)O1

0 references

found in taxon

Annona squamosa

2 references

stated in

Natural acetogenins from annonaceae, synthesis and mechanisms of action

stated in

Annonaceous Acetogenins from the Seeds of Annona squamosa. Adjacent Bis-tetrahydrofuranic Acetogenins.

Identifiers

InChI

InChI=1S/C35H62O6/c1-3-4-5-6-7-11-14-17-20-29(36)31-22-24-33(40-31)34-25-23-32(41-34)30(37)21-18-15-12-9-8-10-13-16-19-28-26-27(2)39-35(28)38/h26-27,29-34,36-37H,3-25H2,1-2H3/t27-,29+,30-,31+,32+,33+,34+/m0/s1

0 references

InChIKey

QAVQPBYIAQGAIO-HCGSSXDTSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QAVQPBYIAQGAIO-HCGSSXDTSA-N

1 reference

(Q105217636)

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

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Identifiers

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