(Q105150672)

English

(2S)-2-methyl-4-[(2R,10R,11R)-2,10,11-trihydroxy-14-[(2S,5R)-5-[(E,1S)-1-hydroxytetradec-9-enyl]oxolan-2-yl]tetradecyl]-2H-furan-5-one

chemical compound

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instance of

type of chemical entity

0 references

subclass of

2-methyl-4-[2,10,11-trihydroxy-14-[5-(1-hydroxytetradec-9-enyl)oxolan-2-yl]tetradecyl]-2H-furan-5-one

1 reference

based on heuristic

inferred from SMILES

mass

622.480854452 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2R)-2-methyl-4-[(2S,10R,11R)-2,10,11-trihydroxy-14-[(2R,5S)-5-[(Z,1S)-1-hydroxytetradec-9-enyl]oxolan-2-yl]tetradecyl]-2H-furan-5-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₃₇H₆₆O₇

0 references

canonical SMILES

O=C1OC(C=C1CC(O)CCCCCCCC(O)C(O)CCCC2OC(CC2)C(O)CCCCCCCC=CCCCC)C

0 references

isomeric SMILES

CCCC/C=C/CCCCCCC[C@H](O)[C@H]1CC[C@H](CCC[C@@H](O)[C@H](O)CCCCCCC[C@@H](O)CC2=C[C@H](C)OC2=O)O1

0 references

found in taxon

Annona senegalensis

1 reference

stated in

Natural acetogenins from annonaceae, synthesis and mechanisms of action

Identifiers

InChI

InChI=1S/C37H66O7/c1-3-4-5-6-7-8-9-10-11-14-18-23-35(41)36-26-25-32(44-36)21-19-24-34(40)33(39)22-17-15-12-13-16-20-31(38)28-30-27-29(2)43-37(30)42/h6-7,27,29,31-36,38-41H,3-5,8-26,28H2,1-2H3/b7-6+/t29-,31+,32-,33+,34+,35-,36+/m0/s1

0 references

InChIKey

LENXDXYFHDZCNH-UPZGFMGYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LENXDXYFHDZCNH-UPZGFMGYSA-N

(Q105150672)

(2S)-2-methyl-4-[(2R,10R,11R)-2,10,11-trihydroxy-14-[(2S,5R)-5-[(E,1S)-1-hydroxytetradec-9-enyl]oxolan-2-yl]tetradecyl]-2H-furan-5-one

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