(Q105177020)

English

(2R)-2-methyl-4-[(2S,8R,11R)-2,8,11-trihydroxy-11-[(2R,5R)-5-[(1R)-1-hydroxypentadecyl]oxolan-2-yl]undecyl]-2H-furan-5-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

(5S)-5-methyl-3-[(2R,11R)-2,8,11-trihydroxy-11-[5-(1-hydroxypentadecyl)oxolan-2-yl]undecyl]-5H-furan-2-one

1 reference

1 reference

596.465204388 dalton

1 reference

2 references

inferred from InChIKey

1 reference

1 reference

(2R)-2-methyl-4-[(2S,8R,11R)-2,8,11-trihydroxy-11-[(2S,5R)-5-[(1S)-1-hydroxypentadecyl]oxolan-2-yl]undecyl]-2H-furan-5-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₅H₆₄O₇

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canonical SMILES

O=C1OC(C=C1CC(O)CCCCCC(O)CCC(O)C2OC(CC2)C(O)CCCCCCCCCCCCCC)C

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isomeric SMILES

CCCCCCCCCCCCCC[C@@H](O)[C@H]1CC[C@H]([C@H](O)CC[C@H](O)CCCCC[C@H](O)CC2=C[C@@H](C)OC2=O)O1

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found in taxon

Annona densicoma

1 reference

stated in

Cytotoxic polyketides from Annona densicoma (annonaceae): 10,13-trans-13,14-erythro-densicomacin, 10,13-trans-13,14-threo-densicomacin, and 8-hydroxyannonacin

Annona glauca

1 reference

stated in

Glaucafilin, an acetogenin from Annona glauca

Identifiers

InChI

InChI=1S/C35H64O7/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-31(38)33-23-24-34(42-33)32(39)22-21-29(36)18-15-14-16-19-30(37)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-/m1/s1

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InChIKey

NBVJDUCRUAUMAA-MOBNURBCSA-N

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1 reference

17 September 2022

inferred from InChIKey

(Q105177020)

(2R)-2-methyl-4-[(2S,8R,11R)-2,8,11-trihydroxy-11-[(2R,5R)-5-[(1R)-1-hydroxypentadecyl]oxolan-2-yl]undecyl]-2H-furan-5-one

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