(Q105120963)

English

3-[2-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]ethyl]furan

chemical compound

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instance of

type of chemical entity

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subclass of

3-[2-(1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)ethyl]furan

1 reference

based on heuristic

inferred from SMILES

mass

286.22966558 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(4aS)-5alpha-[2-(3-Furyl)ethyl]-1,5,6beta,8abeta-tetramethyl-3,4,4aalpha,5,6,7,8,8a-octahydronaphthalene

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₀O

0 references

canonical SMILES

O1C=CC(=C1)CCC2(C)C(C)CCC3(C(=CCCC32)C)C

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isomeric SMILES

CC1=CCC[C@@H]2[C@@](C)(CCc3ccoc3)[C@H](C)CC[C@@]12C

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found in taxon

Baccharis hutchisonii

1 reference

stated in

Clerodane and labdane diterpenoids from Baccharis species

Solidago gigantea

1 reference

stated in

Constituents of Solidago Species. Part VI. The Constitution of Diterpenoids from a Chemically Distinct Variety of Solidagoserotina

Solidago serotina

1 reference

stated in

Constituents of Solidago Species. Part VI. The Constitution of Diterpenoids from a Chemically Distinct Variety of Solidagoserotina

Solidago missouriensis

1 reference

stated in

Constituents of Solidago Species. Part VI. The Constitution of Diterpenoids from a Chemically Distinct Variety of Solidagoserotina

Identifiers

InChI

InChI=1S/C20H30O/c1-15-6-5-7-18-19(15,3)11-8-16(2)20(18,4)12-9-17-10-13-21-14-17/h6,10,13-14,16,18H,5,7-9,11-12H2,1-4H3/t16-,18+,19+,20+/m1/s1

0 references

InChIKey

IVBOCAVCEPSFAH-GTAWCEEGSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

IVBOCAVCEPSFAH-GTAWCEEGSA-N

1 reference

(Q105120963)

3-[2-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]ethyl]furan

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