(Q105366346)

English

(R)-3-[(2R,11R)-11-[[(2R,2'R,5R,5'R)-5'-[(R)-1-Hydroxyundecyl]octahydro-2,2'-bifuran]-5-yl]-2,11-dihydroxyundecyl]-5beta-methylfuran-2(5H)-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

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

1 reference

based on heuristic

inferred from SMILES

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

1 reference

based on heuristic

inferred from SMILES

mass

594.449554324 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2R)-4-[(2S,11R)-2,11-dihydroxy-11-[(2R,5R)-5-[(2R,5R)-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

based on heuristic

inferred from InChI

(2R)-4-[(2S,11R)-2,11-dihydroxy-11-[(2R,5S)-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

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

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

1 reference

based on heuristic

inferred from InChIKey

(2S)-4-[(2R,11R)-2,11-dihydroxy-11-[(2S,5S)-5-[(2S,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

3-{2,11-Dihydroxy-11-[5''-(1-hydroxy-undecyl)-octahydro-[2,2'']bifuranyl-5-yl]-undecyl}-5-methyl-5H-furan-2-one(Rollimembrin)

1 reference

based on heuristic

inferred from InChI

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

1 reference

1 reference

1 reference

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

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₅H₆₂O₇

0 references

canonical SMILES

O=C1OC(C=C1CC(O)CCCCCCCCC(O)C2OC(CC2)C3OC(CC3)C(O)CCCCCCCCCC)C

0 references

isomeric SMILES

CCCCCCCCCC[C@@H](O)[C@H]1CC[C@H]([C@H]2CC[C@H]([C@H](O)CCCCCCCC[C@@H](O)CC3=C[C@@H](C)OC3=O)O2)O1

0 references

found in taxon

Annona bullata

1 reference

stated in

Bullacin: A New Cytotoxic Annonaceous Acetogenin from Annona bullata

Annona glabra

1 reference

stated in

Acetogenins from Annona glabra seeds

Identifiers

InChI

InChI=1S/C35H62O7/c1-3-4-5-6-7-8-12-15-18-29(37)31-20-22-33(41-31)34-23-21-32(42-34)30(38)19-16-13-10-9-11-14-17-28(36)25-27-24-26(2)40-35(27)39/h24,26,28-34,36-38H,3-23,25H2,1-2H3/t26-,28-,29-,30-,31-,32-,33-,34-/m1/s1

0 references

InChIKey

YVZIPERWMPDEIZ-XRAVDUKCSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YVZIPERWMPDEIZ-XRAVDUKCSA-N

1 reference

(Q105366346)

(R)-3-[(2R,11R)-11-[[(2R,2'R,5R,5'R)-5'-[(R)-1-Hydroxyundecyl]octahydro-2,2'-bifuran]-5-yl]-2,11-dihydroxyundecyl]-5beta-methylfuran-2(5H)-one

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