(Q105236062)

English

Cyclopentanecarboxylic acid, 2-methyl-5-(1-methyl-2-oxoethyl)-, [1S-[1alpha,2beta,5beta(S*)]]-

chemical compound

In more languages

Statements

type of chemical entity

0 references

(1R,5R)-2-methyl-5-(1-oxopropan-2-yl)cyclopentane-1-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

(1'R)-Nepetalic acid

1 reference

based on heuristic

inferred from SMILES

184.109944372 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,2S,5R)-2-methyl-5-[(2S)-1-oxopropan-2-yl]cyclopentane-1-carboxylic acid

1 reference

based on heuristic

inferred from InChIKey

(1R,2S,5S)-2-methyl-5-[(2R)-1-oxopropan-2-yl]cyclopentane-1-carboxylic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₀H₁₆O₃

0 references

canonical SMILES

O=CC(C)C1CCC(C)C1C(=O)O

0 references

isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C)C=O)[C@H]1C(=O)O

0 references

1 reference

Structure of nepetalic acid in the solid state and in solution by x-ray diffraction and nuclear magnetic resonance analysis

Identifiers

InChI=1S/C10H16O3/c1-6-3-4-8(7(2)5-11)9(6)10(12)13/h5-9H,3-4H2,1-2H3,(H,12,13)/t6-,7+,8-,9+/m1/s1

0 references

RGTMAXSVLBZNEL-XAVMHZPKSA-N

0 references

CAS Registry Number

1 reference

CAS (formerly Chemical Abstracts Service)

25 January 2022

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

DSSTox substance ID

DTXSID301128268

1 reference

matched by identifier from

RGTMAXSVLBZNEL-XAVMHZPKSA-N

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)

Retrieved from "https://www.wikidata.org/w/index.php?title=Q105236062&oldid=2168058939"