(Q104964683)

English

2-[(1R,3E,6S,7E)-6-acetyloxy-4,8-dimethylcyclodeca-3,7-dien-1-yl]prop-2-enoic acid

chemical compound

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instance of

type of chemical entity

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subclass of

2-(6-Acetyloxy-4,8-dimethylcyclodeca-3,7-dien-1-yl)prop-2-enoic acid

1 reference

based on heuristic

inferred from SMILES

mass

292.167459248 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₇H₂₄O₄

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canonical SMILES

O=C(O)C(=C)C1CC=C(C)CC(OC(=O)C)C=C(C)CC1

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isomeric SMILES

C=C(C(=O)O)[C@H]1C/C=C(\C)C[C@H](OC(C)=O)/C=C(\C)CC1

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found in taxon

Cratystylis conocephala

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stated in

Eudesmanolides and other constituents from Cratystylis conocephala

Identifiers

InChI

InChI=1S/C17H24O4/c1-11-5-7-15(13(3)17(19)20)8-6-12(2)10-16(9-11)21-14(4)18/h5,10,15-16H,3,6-9H2,1-2,4H3,(H,19,20)/b11-5+,12-10+/t15-,16-/m0/s1

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InChIKey

CMJHWCARRCOTJH-YHXAKDQTSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

CMJHWCARRCOTJH-YHXAKDQTSA-N

(Q104964683)

2-[(1R,3E,6S,7E)-6-acetyloxy-4,8-dimethylcyclodeca-3,7-dien-1-yl]prop-2-enoic acid

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