(Q105183017)

English

rel-(1R,3aS,4R,7R,8aR)-1,4-dimethyl-6-methylenedecahydro-4,7-ethanoazulene

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

1,5-dimethyl-9-methylidenetricyclo[6.2.2.0²,⁶]dodecane

1 reference

1 reference

204.187800768 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₅H₂₄

0 references

canonical SMILES

C=C1CC2(C)CCC1CC3C(C)CCC32

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isomeric SMILES

C=C1C[C@@]2(C)CC[C@@H]1C[C@H]1[C@@H]2CC[C@H]1C

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found in taxon

Cyperus rotundus

2 references

stated in

Chemical study of the essential oil of Cyperus rotundus

stated in

Chemical study of the essential oil of Cyperus rotundus

Identifiers

InChI

InChI=1S/C15H24/c1-10-4-5-14-13(10)8-12-6-7-15(14,3)9-11(12)2/h10,12-14H,2,4-9H2,1,3H3/t10-,12-,13-,14+,15-/m1/s1

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InChIKey

NPHFULIVCUBDDN-DVLUHMITSA-N

0 references

2 references

26 December 2021

matched by identifier from

InChIKey

NPHFULIVCUBDDN-DVLUHMITSA-N

1 reference

NMRShiftDB structure ID

2376

1 reference

matched by identifier from

InChIKey

NPHFULIVCUBDDN-DVLUHMITSA-N

KNApSAcK ID

C00053377

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

NPHFULIVCUBDDN-DVLUHMITSA-N

LIPID MAPS ID

LMPR0103850001

1 reference

InChIKey

NPHFULIVCUBDDN-DVLUHMITSA-N

17 April 2021

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

(Q105183017)

rel-(1R,3aS,4R,7R,8aR)-1,4-dimethyl-6-methylenedecahydro-4,7-ethanoazulene

Statements

Identifiers

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