(Q105174690)

English

(1R,4aR,7S,10aR)-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid

group of stereoisomers with the chemical formula C₂₀H₃₀O₂

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Statements

group of stereoisomers

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pimarane diterpenoid

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pimarane diterpenoid

302.2245802 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₀H₃₀O₂

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canonical SMILES

O=C(O)C1(C)CCCC2(C)C3C(=CCC12)CC(C=C)(C)CC3

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isomeric SMILES

C=C[C@@]1(C)CCC2C(=CC[C@H]3[C@](C)(C(=O)O)CCC[C@]23C)C1

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Identifiers

InChI=1S/C20H30O2/c1-5-18(2)12-9-15-14(13-18)7-8-16-19(15,3)10-6-11-20(16,4)17(21)22/h5,7,15-16H,1,6,8-13H2,2-4H3,(H,21,22)/t15?,16-,18+,19-,20-/m1/s1

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MXYATHGRPJZBNA-YLUWNPNHSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

MXYATHGRPJZBNA-YLUWNPNHSA-N

UniChem compound ID

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