(Q105191326)

English

7-[[(1R)-2alpha,4aalpha,5beta,8aalpha-Tetramethyl-3alpha-hydroxy-6-oxodecalin-1alpha-yl]methoxy]coumarin

chemical compound

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instance of

type of chemical entity

0 references

subclass of

biogenic coumarin

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mass

398.20932406 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₄H₃₀O₅

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canonical SMILES

O=C1OC=2C=C(OCC3C(C)C(O)CC4(C)C(C(=O)CCC34C)C)C=CC2C=C1

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isomeric SMILES

C[C@@H]1[C@H](O)C[C@@]2(C)[C@@H](C)C(=O)CC[C@@]2(C)[C@@H]1COc1ccc2ccc(=O)oc2c1

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found in taxon

Ferula sinaica

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stated in

Sesquiterpene coumarins and sesquiterpenes from Ferula sinaica

Identifiers

InChI

InChI=1S/C24H30O5/c1-14-18(13-28-17-7-5-16-6-8-22(27)29-21(16)11-17)23(3)10-9-19(25)15(2)24(23,4)12-20(14)26/h5-8,11,14-15,18,20,26H,9-10,12-13H2,1-4H3/t14-,15-,18+,20+,23-,24-/m0/s1

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InChIKey

OFOSZWHCKXZUKF-IOAHLMNPSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OFOSZWHCKXZUKF-IOAHLMNPSA-N

1 reference

(Q105191326)

7-[[(1R)-2alpha,4aalpha,5beta,8aalpha-Tetramethyl-3alpha-hydroxy-6-oxodecalin-1alpha-yl]methoxy]coumarin

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