(Q105224380)

English

1-[(5aS,6R,9S,9aR)-3,6-dihydroxy-1-methoxy-6-methyl-9-propan-2-yl-7,8,9,9a-tetrahydro-5aH-dibenzofuran-4-yl]-3-phenylprop-2-en-1-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

1-(3,6-dihydroxy-1-methoxy-6-methyl-9-propan-2-yl-7,8,9,9a-tetrahydro-5aH-dibenzofuran-4-yl)-3-phenylprop-2-en-1-one

1 reference

based on heuristic

inferred from SMILES

mass

422.20932406 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(E)-1-[(5aR,6R,9R,9aS)-3,6-dihydroxy-1-methoxy-6-methyl-9-propan-2-yl-7,8,9,9a-tetrahydro-5aH-dibenzofuran-4-yl]-3-phenylprop-2-en-1-one

1 reference

based on heuristic

inferred from InChI

(E)-1-[(5aS,6R,9S,9aR)-3,6-dihydroxy-1-methoxy-6-methyl-9-propan-2-yl-7,8,9,9a-tetrahydro-5aH-dibenzofuran-4-yl]-3-phenylprop-2-en-1-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₆H₃₀O₅

0 references

canonical SMILES

O=C(C=CC=1C=CC=CC1)C2=C(O)C=C(OC)C3=C2OC4C3C(CCC4(O)C)C(C)C

0 references

isomeric SMILES

COc1cc(O)c(C(=O)C=Cc2ccccc2)c2c1[C@H]1[C@H](C(C)C)CC[C@@](C)(O)[C@H]1O2

0 references

found in taxon

Litsea rubescens

1 reference

stated in

Novel cytotoxic chalcones from Litsea rubescens and Litsea pedunculata.

Identifiers

InChI

InChI=1S/C26H30O5/c1-15(2)17-12-13-26(3,29)25-21(17)23-20(30-4)14-19(28)22(24(23)31-25)18(27)11-10-16-8-6-5-7-9-16/h5-11,14-15,17,21,25,28-29H,12-13H2,1-4H3/t17-,21+,25-,26+/m0/s1

0 references

InChIKey

QNFHIVKGSJTPDD-GRZFZBLLSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QNFHIVKGSJTPDD-GRZFZBLLSA-N

(Q105224380)

1-[(5aS,6R,9S,9aR)-3,6-dihydroxy-1-methoxy-6-methyl-9-propan-2-yl-7,8,9,9a-tetrahydro-5aH-dibenzofuran-4-yl]-3-phenylprop-2-en-1-one

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