(Q105298914)

English

(2S)-2-methyl-4-[(2R,5R,6S)-2,5,6-trihydroxy-9-[(2R,5R)-5-[(1S,4S,5S)-1,4,5-trihydroxyheptadecyl]oxolan-2-yl]nonyl]-2H-furan-5-one

chemical compound

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instance of

type of chemical entity

0 references

1 reference

628.455033628 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2S)-2-methyl-4-[(2R,5R,6S)-2,5,6-trihydroxy-9-[(2R,5R)-5-[(1S,4R,5R)-1,4,5-trihydroxyheptadecyl]oxolan-2-yl]nonyl]-2H-furan-5-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(2S)-2-methyl-4-[(2S,5R,6S)-2,5,6-trihydroxy-9-[(2R,5R)-5-[(1S,4R,5R)-1,4,5-trihydroxyheptadecyl]oxolan-2-yl]nonyl]-2H-furan-5-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(2S)-2-methyl-4-[(2R,5S,6S)-2,5,6-trihydroxy-9-[(2R,5S)-5-[(1S,4S,5S)-1,4,5-trihydroxyheptadecyl]oxolan-2-yl]nonyl]-2H-furan-5-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(2S)-2-methyl-4-[(2R,5R,6S)-2,5,6-trihydroxy-9-[(2S,5R)-5-[(1R,4S,5R)-1,4,5-trihydroxyheptadecyl]oxolan-2-yl]nonyl]-2H-furan-5-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(2S)-2-methyl-4-[(2S,5R,6S)-2,5,6-trihydroxy-9-[(2R,5R)-5-[(1S,4R,5S)-1,4,5-trihydroxyheptadecyl]oxolan-2-yl]nonyl]-2H-furan-5-one

2 references

based on heuristic

inferred from InChIKey

1 reference

C₃₅H₆₄O₉

0 references

canonical SMILES

O=C1OC(C=C1CC(O)CCC(O)C(O)CCCC2OC(CC2)C(O)CCC(O)C(O)CCCCCCCCCCCC)C

0 references

isomeric SMILES

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

0 references

found in taxon

Annona muricata

1 reference

stated in

Murihexocins A and B, two novel mono-THF acetogenins with six hydroxyls, from Annona muricata (Annonaceae)

Identifiers

InChI

InChI=1S/C35H64O9/c1-3-4-5-6-7-8-9-10-11-12-15-29(37)32(40)20-21-33(41)34-22-18-28(44-34)14-13-16-30(38)31(39)19-17-27(36)24-26-23-25(2)43-35(26)42/h23,25,27-34,36-41H,3-22,24H2,1-2H3/t25-,27+,28+,29-,30-,31+,32-,33-,34+/m0/s1

0 references

InChIKey

VYEJYURNQIJVJU-QCOQQNJFSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VYEJYURNQIJVJU-QCOQQNJFSA-N

(Q105298914)

(2S)-2-methyl-4-[(2R,5R,6S)-2,5,6-trihydroxy-9-[(2R,5R)-5-[(1S,4S,5S)-1,4,5-trihydroxyheptadecyl]oxolan-2-yl]nonyl]-2H-furan-5-one

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