(Q104984451)

English

[(1R,2S,4aR,8aR)-1-acetyloxy-1,4a-dimethyl-6-oxo-7-propan-2-ylidene-2,3,4,5,8,8a-hexahydronaphthalen-2-yl] (Z)-2-methylbut-2-enoate

chemical compound

In more languages

Statements

type of chemical entity

0 references

(1-Acetyloxy-1,4a-dimethyl-6-oxo-7-propan-2-ylidene-2,3,4,5,8,8a-hexahydronaphthalen-2-yl) 2-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

376.224974124 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(1S,2R,4aR,8aR)-1-acetyloxy-1,4a-dimethyl-6-oxo-7-propan-2-ylidene-2,3,4,5,8,8a-hexahydronaphthalen-2-yl] (Z)-2-methylbut-2-enoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

[(1S,2R,4aR,8aR)-1-acetyloxy-1,4a-dimethyl-6-oxo-7-propan-2-ylidene-2,3,4,5,8,8a-hexahydronaphthalen-2-yl] 2-methylbut-2-enoate

1 reference

based on heuristic

inferred from InChI

[(1S,2S,4aR,8aR)-1-acetyloxy-1,4a-dimethyl-6-oxo-7-propan-2-ylidene-2,3,4,5,8,8a-hexahydronaphthalen-2-yl] (Z)-2-methylbut-2-enoate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₂H₃₂O₅

0 references

canonical SMILES

O=C(OC1CCC2(C)CC(=O)C(=C(C)C)CC2C1(OC(=O)C)C)C(=CC)C

0 references

isomeric SMILES

C/C=C(/C)C(=O)O[C@H]1CC[C@]2(C)CC(=O)C(=C(C)C)C[C@H]2[C@@]1(C)OC(C)=O

0 references

Pluchea sagittalis

1 reference

Eudesmane derivatives from Pluchea quitoc

Identifiers

InChI=1S/C22H32O5/c1-8-14(4)20(25)26-19-9-10-21(6)12-17(24)16(13(2)3)11-18(21)22(19,7)27-15(5)23/h8,18-19H,9-12H2,1-7H3/b14-8-/t18-,19+,21-,22-/m1/s1

0 references

DLLCYEYTXHAUTA-WLNGMFAOSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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