(Q105222423)

English

[7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-yl] 5-(5-acetyloxy-3-methylpent-3-enyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate

group of stereoisomers with the chemical formula C₃₇H₆₀O₅

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Statements

group of stereoisomers

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eudesmane sesquiterpenoid

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eudesmane sesquiterpenoid

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584.8707 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₇H₆₀O₅

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canonical SMILES

O=C(OCC=C(C)CCC1C(=C)CCC2C(C(=O)OC3(C)CCCC4(C)CCC(CC34)C(O)(C)C)(C)CCCC12C)C

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Identifiers

InChI=1S/C37H60O5/c1-25(17-23-41-27(3)38)12-14-29-26(2)13-15-30-35(29,7)19-11-20-36(30,8)32(39)42-37(9)21-10-18-34(6)22-16-28(24-31(34)37)33(4,5)40/h17,28-31,40H,2,10-16,18-24H2,1,3-9H3

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QIVLWPIJESKEMW-UHFFFAOYSA-N

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1 reference

based on heuristic

inferred from InChIKey

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