(Q105292467)

English

(2S)-2-methyl-4-[12-[(2R,3R)-3-[2-[(2R,3R)-3-tetradecyloxiran-2-yl]ethyl]oxiran-2-yl]dodecyl]-2H-furan-5-one

chemical compound

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instance of

type of chemical entity

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1 reference

574.496110592 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2R)-2-methyl-4-[12-[(2R,3R)-3-[2-[(2R,3R)-3-tetradecyloxiran-2-yl]ethyl]oxiran-2-yl]dodecyl]-2H-furan-5-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₇H₆₆O₄

0 references

canonical SMILES

O=C1OC(C=C1CCCCCCCCCCCCC2OC2CCC3OC3CCCCCCCCCCCCCC)C

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isomeric SMILES

CCCCCCCCCCCCCC[C@H]1O[C@@H]1CC[C@H]1O[C@@H]1CCCCCCCCCCCCC1=C[C@H](C)OC1=O

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found in taxon

Annona rensoniana

1 reference

stated in

Natural acetogenins from annonaceae, synthesis and mechanisms of action

Identifiers

InChI

InChI=1S/C37H66O4/c1-3-4-5-6-7-8-9-10-14-17-20-23-26-33-35(40-33)28-29-36-34(41-36)27-24-21-18-15-12-11-13-16-19-22-25-32-30-31(2)39-37(32)38/h30-31,33-36H,3-29H2,1-2H3/t31-,33+,34+,35+,36+/m0/s1

0 references

InChIKey

VSRQGFZOPBDXOA-AYJUPLJXSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VSRQGFZOPBDXOA-AYJUPLJXSA-N

(Q105292467)

(2S)-2-methyl-4-[12-[(2R,3R)-3-[2-[(2R,3R)-3-tetradecyloxiran-2-yl]ethyl]oxiran-2-yl]dodecyl]-2H-furan-5-one

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