(6aR,7S,10aS)-7-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]-7-methyl-1,5,6,6a,8,10-hexahydrobenzo[d][2]benzofuran-3,9-dione (Q104946493)

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chemical compound

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Language	Label	Description	Also known as
English	(6aR,7S,10aS)-7-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]-7-methyl-1,5,6,6a,8,10-hexahydrobenzo[d][2]benzofuran-3,9-dione	chemical compound

Statements

instance of

type of chemical entity

0 references

subclass of

7-[2-(Furan-3-yl)-2-hydroxyethyl]-7-methyl-1,5,6,6a,8,10-hexahydrobenzo[d][2]benzofuran-3,9-dione

1 reference

based on heuristic

inferred from SMILES

mass

330.146723804 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₉H₂₂O₅

0 references

canonical SMILES

O=C1OCC23C1=CCCC2C(C)(CC(=O)C3)CC(O)C4=COC=C4

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isomeric SMILES

C[C@]1(C[C@H](O)c2ccoc2)CC(=O)C[C@@]23COC(=O)C2=CCC[C@H]13

0 references

found in taxon

Baccharis scoparia

1 reference

stated in

Clerodane and labdane diterpenoids from Baccharis species

Identifiers

InChI

InChI=1S/C19H22O5/c1-18(9-15(21)12-5-6-23-10-12)7-13(20)8-19-11-24-17(22)14(19)3-2-4-16(18)19/h3,5-6,10,15-16,21H,2,4,7-9,11H2,1H3/t15-,16+,18+,19+/m0/s1

0 references

InChIKey

BVFBGGIMAWCXJT-QFHJOOASSA-N

0 references

PubChem CID

162963030

2 references

stated in

PubChem

retrieved

17 September 2022

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

BVFBGGIMAWCXJT-QFHJOOASSA-N

 

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