(Q105214902)

English

[(14R)-14-hydroxy-5,5,9-trimethyl-6-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-14-yl]methyl acetate

group of stereoisomers with the chemical formula C₂₂H₃₄O₄

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Statements

group of stereoisomers

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kaurane diterpenoid

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kaurane diterpenoid

362.245709568 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₂H₃₄O₄

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canonical SMILES

O=C(OCC1(O)CC23CCC4C(C(=O)CCC4(C)C3CCC1C2)(C)C)C

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isomeric SMILES

CC(=O)OC[C@@]1(O)CC23CCC4C(C)(C)C(=O)CCC4(C)C2CCC1C3

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Identifiers

InChI=1S/C22H34O4/c1-14(23)26-13-22(25)12-21-10-7-16-19(2,3)18(24)8-9-20(16,4)17(21)6-5-15(22)11-21/h15-17,25H,5-13H2,1-4H3/t15?,16?,17?,20?,21?,22-/m0/s1

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PTVDSZPMJVQUCE-BPGDDYFPSA-N

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based on heuristic

inferred from InChIKey

matched by identifier from

PTVDSZPMJVQUCE-BPGDDYFPSA-N

UniChem compound ID

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