(Q105215038)

English

(2R)-4-[(2S)-2-hydroxy-7-[(2S,5S)-5-[(1R,4S,5R,10R)-1,4,5,10-tetrahydroxynonadecyl]oxolan-2-yl]heptyl]-2-methyl-2H-furan-5-one

chemical compound

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instance of

type of chemical entity

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subclass of

chemical compound

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mass

612.460119008 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₅H₆₄O₈

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canonical SMILES

O=C1OC(C=C1CC(O)CCCCCC2OC(CC2)C(O)CCC(O)C(O)CCCCC(O)CCCCCCCCC)C

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isomeric SMILES

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

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found in taxon

Annona muricata

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stated in

Natural acetogenins from annonaceae, synthesis and mechanisms of action

Identifiers

InChI

InChI=1S/C35H64O8/c1-3-4-5-6-7-8-10-15-28(36)16-13-14-19-31(38)32(39)21-22-33(40)34-23-20-30(43-34)18-12-9-11-17-29(37)25-27-24-26(2)42-35(27)41/h24,26,28-34,36-40H,3-23,25H2,1-2H3/t26-,28-,29+,30+,31-,32+,33-,34+/m1/s1

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InChIKey

PUEQYPBAQMXBCO-VSMQDCFVSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PUEQYPBAQMXBCO-VSMQDCFVSA-N

1 reference

(Q105215038)

(2R)-4-[(2S)-2-hydroxy-7-[(2S,5S)-5-[(1R,4S,5R,10R)-1,4,5,10-tetrahydroxynonadecyl]oxolan-2-yl]heptyl]-2-methyl-2H-furan-5-one

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Identifiers

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