(Q105257194)

English

7-[(2E,6E,10S)-10,11-dihydroxy-3,7,11-trimethyldodeca-2,6-dienoxy]chromen-2-one

chemical compound

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Statements

instance of

type of chemical entity

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1 reference

7-[(10,11-dihydroxy-3,7,11-trimethyldodeca-2,6-dien-1-yl)oxy]chromen-2-one

1 reference

based on heuristic

inferred from SMILES

mass

400.224974124 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

7-[(6E,10R)-10,11-dihydroxy-3,7,11-trimethyldodeca-2,6-dienoxy]chromen-2-one

1 reference

based on heuristic

inferred from InChI

7-[[(2E,6E,10R)-3,7,11-Trimethyl-10,11-dihydroxy-2,6-dodecadienyl]oxy]coumarin

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₄H₃₂O₅

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canonical SMILES

O=C1OC=2C=C(OCC=C(C)CCC=C(C)CCC(O)C(O)(C)C)C=CC2C=C1

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isomeric SMILES

C/C(=C\COc1ccc2ccc(=O)oc2c1)CC/C=C(\C)CC[C@H](O)C(C)(C)O

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found in taxon

Ferula assa-foetida

1 reference

stated in

Sesquiterpene Coumarins fromFerula Foetida

Ferula foetida

1 reference

stated in

Sesquiterpene Coumarins fromFerula Foetida

Identifiers

InChI

InChI=1S/C24H32O5/c1-17(8-12-22(25)24(3,4)27)6-5-7-18(2)14-15-28-20-11-9-19-10-13-23(26)29-21(19)16-20/h6,9-11,13-14,16,22,25,27H,5,7-8,12,15H2,1-4H3/b17-6+,18-14+/t22-/m0/s1

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InChIKey

SOTUFGKJQVSOCT-DZMBJMNISA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q105257194)

7-[(2E,6E,10S)-10,11-dihydroxy-3,7,11-trimethyldodeca-2,6-dienoxy]chromen-2-one

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