(Q105233311)

English

(2S)-4-[(13R)-13-Hydroxy-13-[(2R,5R)-5-[(1R)-1-hydroxytridecyl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one

chemical compound

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instance of

type of chemical entity

0 references

subclass of

4-[13-hydroxy-13-[5-(1-hydroxytridecyl)oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one

1 reference

based on heuristic

inferred from SMILES

mass

564.475375148 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

3-[(R)-13-[5beta-[(S)-1-Hydroxytridecyl]-2,3,4,5-tetrahydrofuran-2beta-yl]-13-hydroxytridecyl]-5beta-methyl-2(5H)-furanone

1 reference

1 reference

(2R)-4-[(13R)-13-hydroxy-13-[(2S,5R)-5-[(1S)-1-hydroxytridecyl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one

1 reference

based on heuristic

inferred from InChI

(2R)-4-[(13R)-13-hydroxy-13-[(2R,5R)-5-[(1R)-1-hydroxytridecyl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₅H₆₄O₅

0 references

canonical SMILES

O=C1OC(C=C1CCCCCCCCCCCCC(O)C2OC(CC2)C(O)CCCCCCCCCCCC)C

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isomeric SMILES

CCCCCCCCCCCC[C@@H](O)[C@H]1CC[C@H]([C@H](O)CCCCCCCCCCCCC2=C[C@H](C)OC2=O)O1

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found in taxon

Annona glabra

1 reference

stated in

Annonacin, a novel, biologically active polyketide from Annona densicoma

Annona muricata

1 reference

stated in

Natural acetogenins from annonaceae, synthesis and mechanisms of action

Annona reticulata

1 reference

stated in

Studies on the acetogenins of Formosan annonaceous plants. II. Cytotoxic acetogenins from Annona reticulata

Annona squamosa

2 references

stated in

Nematicidal and antifungal activities of annonaceous acetogenins from Annona squamosa against various plant pathogens.

stated in

Annonaceous acetogenins: Precursors from the seeds of Annona squamosa

Identifiers

InChI

InChI=1S/C35H64O5/c1-3-4-5-6-7-8-12-15-18-21-24-31(36)33-26-27-34(40-33)32(37)25-22-19-16-13-10-9-11-14-17-20-23-30-28-29(2)39-35(30)38/h28-29,31-34,36-37H,3-27H2,1-2H3/t29-,31+,32+,33+,34+/m0/s1

0 references

InChIKey

RBSBTRALZZSVBA-OTUMHNDOSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q105233311)

(2S)-4-[(13R)-13-Hydroxy-13-[(2R,5R)-5-[(1R)-1-hydroxytridecyl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one

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