(Q105214949)

English

Epoxymurin B

group of stereoisomers with the chemical formula C₃₅H₆₂O₃

In more languages

Statements

group of stereoisomers

0 references

chemical compound

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530.469895844 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₅H₆₂O₃

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canonical SMILES

O=C1OC(C=C1CCCCCCCCCCCCC=CCCC2OC2CCCCCCCCCCCC)C

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isomeric SMILES

CCCCCCCCCCCCC1OC1CC/C=C\CCCCCCCCCCCCC1=CC(C)OC1=O

1 reference

based on heuristic

inferred from InChI

Annona muricata

3 references

Two acetogenins from Annona muricata seeds

Cohibins A and B, acetogenins from roots of Annona muricata

Epoxymurins A and B, two biogenetic precursors of annonaceous acetogenins from annona muricata

Identifiers

InChI=1S/C35H62O3/c1-3-4-5-6-7-8-16-19-22-25-28-33-34(38-33)29-26-23-20-17-14-12-10-9-11-13-15-18-21-24-27-32-30-31(2)37-35(32)36/h20,23,30-31,33-34H,3-19,21-22,24-29H2,1-2H3/b23-20-

0 references

PTXDXCCEDUBSJA-ATJXCDBQSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

mapping relation type

1 reference

matched by identifier from

International Chemical Identifier

InChI=1S/C35H62O3/c1-3-4-5-6-7-8-16-19-22-25-28-33-34(38-33)29-26-23-20-17-14-12-10-9-11-13-15-18-21-24-27-32-30-31(2)37-35(32)36/h20,23,30-31,33-34H,3-19,21-22,24-29H2,1-2H3/b23-20-

UniChem compound ID

1 reference

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

PTXDXCCEDUBSJA-ATJXCDBQSA-N

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