(Q105214145)

English

(2S)-4-[(2R)-2-hydroxy-14-[(2R,5S)-5-[(1S,4R,5S)-1,4,5-trihydroxydodecyl]oxolan-2-yl]tetradecyl]-2-methyl-2H-furan-5-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

4-[2-hydroxy-14-[5-(1,4,5-trihydroxydodecyl)oxolan-2-yl]tetradecyl]-2-methyl-2H-furan-5-one

1 reference

1 reference

596.465204388 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2S)-4-[(2R)-2-hydroxy-14-[(2R,5S)-5-[(1S,4S,5R)-1,4,5-trihydroxydodecyl]oxolan-2-yl]tetradecyl]-2-methyl-2H-furan-5-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₃₅H₆₄O₇

0 references

canonical SMILES

O=C1OC(C=C1CC(O)CCCCCCCCCCCCC2OC(CC2)C(O)CCC(O)C(O)CCCCCCC)C

0 references

isomeric SMILES

CCCCCCC[C@H](O)[C@H](O)CC[C@H](O)[C@@H]1CC[C@@H](CCCCCCCCCCCC[C@@H](O)CC2=C[C@H](C)OC2=O)O1

0 references

found in taxon

Annona muricata

1 reference

stated in

Novel cytotoxic annonaceous acetogenins from Annona muricata

Identifiers

InChI

InChI=1S/C35H64O7/c1-3-4-5-12-17-20-31(37)32(38)22-23-33(39)34-24-21-30(42-34)19-16-14-11-9-7-6-8-10-13-15-18-29(36)26-28-25-27(2)41-35(28)40/h25,27,29-34,36-39H,3-24,26H2,1-2H3/t27-,29+,30+,31-,32+,33-,34-/m0/s1

0 references

InChIKey

PSEVENSSBONHMB-RLWOUWICSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105214145)

(2S)-4-[(2R)-2-hydroxy-14-[(2R,5S)-5-[(1S,4R,5S)-1,4,5-trihydroxydodecyl]oxolan-2-yl]tetradecyl]-2-methyl-2H-furan-5-one

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Identifiers

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