(2E,4E,6E,8E,10E,12Z,14Z,16E)-17-(4-hydroxy-2,6,6-trimethyl-3-oxocyclohexa-1,4-dien-1-yl)-2,6,11,15-tetramethylheptadeca-2,4,6,8,10,12,14,16-octaenal (Q104909830)

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chemical compound

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Language	Label	Description	Also known as
English	(2E,4E,6E,8E,10E,12Z,14Z,16E)-17-(4-hydroxy-2,6,6-trimethyl-3-oxocyclohexa-1,4-dien-1-yl)-2,6,11,15-tetramethylheptadeca-2,4,6,8,10,12,14,16-octaenal	chemical compound

Statements

instance of

type of chemical entity

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subclass of

apocarotenoid

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mass

444.266445012 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₃₆O₃

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canonical SMILES

O=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC1=C(C(=O)C(O)=CC1(C)C)C)C)C)C)C

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isomeric SMILES

CC1=C(/C=C/C(C)=C\C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(\C)C=O)C(C)(C)C=C(O)C1=O

1 reference

based on heuristic

inferred from InChI

found in taxon

Hexabranchus

1 reference

stated in

Novel Apocarotenoid Apoastacenal Isolated from Nudibranch Eggmasses

Identifiers

InChI

InChI=1S/C30H36O3/c1-22(12-8-9-13-23(2)15-11-17-25(4)21-31)14-10-16-24(3)18-19-27-26(5)29(33)28(32)20-30(27,6)7/h8-21,32H,1-7H3/b9-8+,14-10-,15-11+,19-18+,22-12+,23-13+,24-16-,25-17+

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InChIKey

ADVPNSBGTALRGR-CAMOGPBFSA-N

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