(Q105157704)

English

(6aR,7S,8R,10aS)-7,8-dimethyl-7-[2-[(3R)-5-oxooxolan-3-yl]ethyl]-1,5,6,6a,8,10-hexahydrobenzo[d][2]benzofuran-3,9-dione

chemical compound

In more languages

Statements

type of chemical entity

0 references

7,8-Dimethyl-7-[2-(5-oxooxolan-3-yl)ethyl]-1,5,6,6a,8,10-hexahydrobenzo[d][2]benzofuran-3,9-dione

1 reference

based on heuristic

inferred from SMILES

346.178023932 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(6aR,7S,8S,10aS)-7,8-dimethyl-7-[2-[(3R)-5-oxooxolan-3-yl]ethyl]-1,5,6,6a,8,10-hexahydrobenzo[d][2]benzofuran-3,9-dione

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(6aR,7R,8R,10aS)-7,8-dimethyl-7-[2-[(3R)-5-oxooxolan-3-yl]ethyl]-1,5,6,6a,8,10-hexahydrobenzo[d][2]benzofuran-3,9-dione

1 reference

based on heuristic

inferred from InChI

(6aR,7R,8S,10aS)-7,8-dimethyl-7-[2-[(3R)-5-oxooxolan-3-yl]ethyl]-1,5,6,6a,8,10-hexahydrobenzo[d][2]benzofuran-3,9-dione

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₆O₅

0 references

canonical SMILES

O=C1OCC23C1=CCCC2C(C)(CCC4COC(=O)C4)C(C(=O)C3)C

0 references

isomeric SMILES

C[C@H]1C(=O)C[C@@]23COC(=O)C2=CCC[C@@H]3[C@]1(C)CC[C@H]1COC(=O)C1

0 references

Baccharis gaudichaudiana

1 reference

Gaudichanolides A and B, clerodane diterpenes from Baccharis gaudichaudiana

Identifiers

InChI=1S/C20H26O5/c1-12-15(21)9-20-11-25-18(23)14(20)4-3-5-16(20)19(12,2)7-6-13-8-17(22)24-10-13/h4,12-13,16H,3,5-11H2,1-2H3/t12-,13+,16+,19+,20+/m0/s1

0 references

LUYUZBFGBTZZHC-QPPJPHRYSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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