(Q105115382)

English

7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid

group of stereoisomers with the chemical formula C₂₀H₂₈O₃

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Statements

group of stereoisomers

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abietane diterpenoid

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abietane diterpenoid

316.20384475599997 dalton

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based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₈O₃

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canonical SMILES

O=C(O)C1(C)CCCC2(C3=CC=C(C=C3CCC12)C(O)(C)C)C

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Identifiers

InChI=1S/C20H28O3/c1-18(2,23)14-7-8-15-13(12-14)6-9-16-19(15,3)10-5-11-20(16,4)17(21)22/h7-8,12,16,23H,5-6,9-11H2,1-4H3,(H,21,22)

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ILQLITDRYFHAGM-UHFFFAOYSA-N

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based on heuristic

inferred from InChIKey

matched by identifier from

ILQLITDRYFHAGM-UHFFFAOYSA-N

UniChem compound ID

1 reference

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