(Q105157057)

English

3-[(1,2,4a-trimethyl-5-methylidene-hexahydro-2H-naphthalen-1-yl)methyl]-5-amino-2-hydroxycyclohexa-2,5-diene-1,4-dione

group of stereoisomers with the chemical formula C₂₁H₂₉NO₃

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Statements

group of stereoisomers

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chemical compound

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343.214743788 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₉NO₃

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canonical SMILES

O=C1C=C(N)C(=O)C(=C1O)CC2(C)C(C)CCC3(C(=C)CCCC32)C

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Identifiers

InChI=1S/C21H29NO3/c1-12-6-5-7-17-20(12,3)9-8-13(2)21(17,4)11-14-18(24)15(22)10-16(23)19(14)25/h10,13,17,25H,1,5-9,11,22H2,2-4H3

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LTNUWWZNTOSEML-UHFFFAOYSA-N

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