(Q105268860)

English

(2R)-2-methyl-4-[(2R,6R,8S,10R,13R)-2,6,8,10,13-pentahydroxy-13-[(2R,5R)-5-[(1R)-1-hydroxytridecyl]oxolan-2-yl]tridecyl]-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

chemical formula

C₃₅H₆₄O₉

0 references

canonical SMILES

O=C1OC(C=C1CC(O)CCCC(O)CC(O)CC(O)CCC(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)CC[C@@H](O)C[C@@H](O)C[C@H](O)CCC[C@@H](O)CC2=C[C@@H](C)OC2=O)O1

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found in taxon

Annona muricata

1 reference

stated in

Natural acetogenins from annonaceae, synthesis and mechanisms of action

Identifiers

InChI

InChI=1S/C35H64O9/c1-3-4-5-6-7-8-9-10-11-12-16-31(40)33-19-20-34(44-33)32(41)18-17-29(38)24-30(39)23-28(37)15-13-14-27(36)22-26-21-25(2)43-35(26)42/h21,25,27-34,36-41H,3-20,22-24H2,1-2H3/t25-,27-,28-,29-,30+,31-,32-,33-,34-/m1/s1

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InChIKey

UAKTZILOYPPNCD-BXGWUYTNSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

UAKTZILOYPPNCD-BXGWUYTNSA-N

(Q105268860)

(2R)-2-methyl-4-[(2R,6R,8S,10R,13R)-2,6,8,10,13-pentahydroxy-13-[(2R,5R)-5-[(1R)-1-hydroxytridecyl]oxolan-2-yl]tridecyl]-2H-furan-5-one

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