(Q105181021)

English

3-Methyl-2-butenoic acid [(3R)-3beta-isopropenyl-4abeta,5beta-dimethyl-2,3,4,4a,5,6,7,8-octahydro-2-oxonaphthalen]-6alpha-yl ester

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

(1,8a-Dimethyl-6-oxo-7-prop-1-en-2-yl-1,2,3,4,7,8-hexahydronaphthalen-2-yl) 3-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

316.203844756 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3S)-3alpha-Isopropenyl-4abeta,5beta-dimethyl-6alpha-(3-methyl-2-butenoyloxy)-2,3,4,4a,5,6,7,8-octahydronaphthalene-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₈O₃

0 references

canonical SMILES

O=C(OC1CCC2=CC(=O)C(C(=C)C)CC2(C)C1C)C=C(C)C

0 references

isomeric SMILES

C=C(C)[C@H]1C[C@@]2(C)C(=CC1=O)CC[C@@H](OC(=O)C=C(C)C)[C@@H]2C

0 references

found in taxon

Petasites hybridus

1 reference

stated in

Struktur der Sesquiterpene vonPetasites hybridus(L.)G. M.etSCH.: Neopetasol-Abkömmlinge

Senecio cathcartensis

1 reference

stated in

Neue eremophilene aus südafrikanischen Senecio-arten

Identifiers

InChI

InChI=1S/C20H28O3/c1-12(2)9-19(22)23-18-8-7-15-10-17(21)16(13(3)4)11-20(15,6)14(18)5/h9-10,14,16,18H,3,7-8,11H2,1-2,4-6H3/t14-,16+,18+,20+/m0/s1

0 references

InChIKey

NKTAEKGPSITXNF-JYJIFUJCSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NKTAEKGPSITXNF-JYJIFUJCSA-N

1 reference

(Q105181021)

3-Methyl-2-butenoic acid [(3R)-3beta-isopropenyl-4abeta,5beta-dimethyl-2,3,4,4a,5,6,7,8-octahydro-2-oxonaphthalen]-6alpha-yl ester

Statements

Identifiers

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)