(Q105365195)

English

Cycloneomammein

group of stereoisomers with the chemical formula C₂₂H₂₈O₆

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Statements

group of stereoisomers

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chemical compound

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388.188588616 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₈O₆

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canonical SMILES

O=C1OC2=C(C(O)=C3C(OC(C3)C(O)(C)C)=C2C(=C1)CCC)C(=O)C(C)CC

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Mammea americana

1 reference

Constituents of Mammea americana L. 8. Novel structural variations on the mammein theme and antitumor activity of mammein and related coumarin and phloroglucinol derivatives

Identifiers

InChI=1S/C22H28O6/c1-6-8-12-9-15(23)28-21-16(12)20-13(10-14(27-20)22(4,5)26)19(25)17(21)18(24)11(3)7-2/h9,11,14,25-26H,6-8,10H2,1-5H3

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YVCSPVUIXKMOLW-UHFFFAOYSA-N

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CAS Registry Number

1 reference

CAS (formerly Chemical Abstracts Service)

25 January 2022

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26 December 2021

matched by identifier from

YVCSPVUIXKMOLW-UHFFFAOYSA-N

mapping relation type

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ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI=1S/C22H28O6/c1-6-8-12-9-15(23)28-21-16(12)20-13(10-14(27-20)22(4,5)26)19(25)17(21)18(24)11(3)7-2/h9,11,14,25-26H,6-8,10H2,1-5H3

UniChem compound ID

1 reference

DSSTox substance ID

DTXSID501106173

1 reference

matched by identifier from

YVCSPVUIXKMOLW-UHFFFAOYSA-N

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

YVCSPVUIXKMOLW-UHFFFAOYSA-N

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