(Q105304967)

English

(1S,4aR)-1beta-[[(2S,3S)-3-Vinyl-3-methyloxiranyl]methyl]-2-methylene-5,8abeta-dimethyldecahydronaphthalene-5beta-carboxylic acid

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

5-[(3-ethenyl-3-methyloxiran-2-yl)methyl]-1,4a-dimethyl-6-methylidene-hexahydro-2H-naphthalene-1-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

mass

318.21949482 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S,4aR,5S,8aR)-5-[[(2S,3R)-3-ethenyl-3-methyloxiran-2-yl]methyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₀O₃

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canonical SMILES

O=C(O)C1(C)CCCC2(C)C(C(=C)CCC12)CC3OC3(C=C)C

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isomeric SMILES

C=C[C@]1(C)O[C@H]1C[C@H]1C(=C)CC[C@H]2[C@@](C)(C(=O)O)CCC[C@]12C

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found in taxon

Juniperus chinensis

1 reference

stated in

Diterpenes from the bark of Juniperus chinensis

Fokienia hodginsii

1 reference

stated in

Diterpenoids from the twigs and leaves of Fokienia hodginsii

Identifiers

InChI

InChI=1S/C20H30O3/c1-6-20(5)16(23-20)12-14-13(2)8-9-15-18(14,3)10-7-11-19(15,4)17(21)22/h6,14-16H,1-2,7-12H2,3-5H3,(H,21,22)/t14-,15+,16-,18+,19-,20-/m0/s1

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InChIKey

WGURGXZGVSMKKG-ZYLYKIMZSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WGURGXZGVSMKKG-ZYLYKIMZSA-N

1 reference

(Q105304967)

(1S,4aR)-1beta-[[(2S,3S)-3-Vinyl-3-methyloxiranyl]methyl]-2-methylene-5,8abeta-dimethyldecahydronaphthalene-5beta-carboxylic acid

Statements

Identifiers

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