(Q104909370)

English

(4aR,5S,8aS)-5,8a-dimethyl-5-[(1R,3R,6S)-2-oxo-6-propan-2-yl-7-oxabicyclo[4.1.0]heptan-3-yl]-1,4,4a,6,7,8-hexahydroisochromen-3-one

chemical compound

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default for all languages

No label defined

No description defined

Statements

type of chemical entity

0 references

5,8a-Dimethyl-5-(2-oxo-6-propan-2-yl-7-oxabicyclo[4.1.0]heptan-3-yl)-1,4,4a,6,7,8-hexahydroisochromen-3-one

1 reference

based on heuristic

inferred from SMILES

334.21440944 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₀O₄

0 references

canonical SMILES

O=C1OCC2(C)CCCC(C)(C3C(=O)C4OC4(CC3)C(C)C)C2C1

0 references

isomeric SMILES

CC(C)[C@@]12CC[C@H]([C@@]3(C)CCC[C@]4(C)COC(=O)C[C@@H]43)C(=O)[C@@H]1O2

0 references

Juniperus chinensis

1 reference

Diterpenes from leaves of Juniperus chinensis

Identifiers

InChI=1S/C20H30O4/c1-12(2)20-9-6-13(16(22)17(20)24-20)19(4)8-5-7-18(3)11-23-15(21)10-14(18)19/h12-14,17H,5-11H2,1-4H3/t13-,14-,17-,18+,19+,20-/m0/s1

0 references

ACXMHGLFKFRSLN-XGBBNYNSSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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