(Q105252665)

English

[3-[(6,6-Dimethyl-2-bicyclo[3.1.1]hept-2-enyl)methyl]-10-hydroxy-2,11-dimethyl-7-methylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-1(13)-en-9-yl] 2-methylbut-2-enoate

group of stereoisomers with the chemical formula C₃₀H₃₈O₇

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

510.261753556 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₃₈O₇

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canonical SMILES

O=C(OC1C(O)C2(OC(=CC2=O)C(C)C(CC3=CCC4CC3C4(C)C)C5OC(=O)C(=C)C15)C)C(=CC)C

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found in taxon

Calea hispida

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stated in

Furanoheliangolides and farnesol derivatives from Calea hispida

Calea triantha

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stated in

Furanoheliangolides and farnesol derivatives from Calea hispida

Identifiers

InChI

InChI=1S/C30H38O7/c1-8-14(2)27(33)36-25-23-16(4)28(34)35-24(23)19(11-17-9-10-18-12-20(17)29(18,5)6)15(3)21-13-22(31)30(7,37-21)26(25)32/h8-9,13,15,18-20,23-26,32H,4,10-12H2,1-3,5-7H3

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InChIKey

SGVKVTHSMHIGBU-UHFFFAOYSA-N

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1 reference

17 September 2022

inferred from InChIKey

(Q105252665)

[3-[(6,6-Dimethyl-2-bicyclo[3.1.1]hept-2-enyl)methyl]-10-hydroxy-2,11-dimethyl-7-methylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-1(13)-en-9-yl] 2-methylbut-2-enoate

Statements

Identifiers

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