(Q104955214)

English

5-(5-methoxycarbonyl-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl)-3-methylpentanoic acid

group of stereoisomers with the chemical formula C₂₁H₃₂O₅

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Statements

group of stereoisomers

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clerodane diterpenoid

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clerodane diterpenoid

364.22497412399986 dalton

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based on heuristic

inferred from InChI

chemical formula

C₂₁H₃₂O₅

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canonical SMILES

O=C(OC)C1=CC(=O)CC2C1(C)CCC(C)C2(C)CCC(C)CC(=O)O

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Identifiers

InChI=1S/C21H32O5/c1-13(10-18(23)24)6-8-20(3)14(2)7-9-21(4)16(19(25)26-5)11-15(22)12-17(20)21/h11,13-14,17H,6-10,12H2,1-5H3,(H,23,24)

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CDUCXJMEMPCZPY-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

CDUCXJMEMPCZPY-UHFFFAOYSA-N

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