(Q105233925)

English

[(1S,3S,4aR,5R,6R,8aR)-4a,5-dimethyl-6-(3-methylbut-2-enoyloxy)-2-oxo-3-prop-1-en-2-yl-1,3,4,5,6,7,8,8a-octahydronaphthalen-1-yl] (E)-2-methylbut-2-enoate

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

[4a,5-Dimethyl-6-(3-methylbut-2-enoyloxy)-2-oxo-3-prop-1-en-2-yl-1,3,4,5,6,7,8,8a-octahydronaphthalen-1-yl] 2-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

416.256274252 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(1R,3R,4aR,5R,6R,8aS)-4a,5-dimethyl-6-(3-methylbut-2-enoyloxy)-2-oxo-3-prop-1-en-2-yl-1,3,4,5,6,7,8,8a-octahydronaphthalen-1-yl] (Z)-2-methylbut-2-enoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

[(1R,3R,4aR,5R,6R,8aS)-4a,5-dimethyl-6-(3-methylbut-2-enoyloxy)-2-oxo-3-prop-1-en-2-yl-1,3,4,5,6,7,8,8a-octahydronaphthalen-1-yl] (E)-2-methylbut-2-enoate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₅H₃₆O₅

0 references

canonical SMILES

O=C(OC1CCC2C(OC(=O)C(=CC)C)C(=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@@H](CC[C@@H](OC(=O)C=C(C)C)[C@@H]2C)[C@H](OC(=O)/C(C)=C/C)C1=O

0 references

found in taxon

Senecio umgeniensis

1 reference

stated in

Further pyrrolizidine alkaloids and furoeremophilanes from Senecio species

Senecio variabilis

1 reference

stated in

Further pyrrolizidine alkaloids and furoeremophilanes from Senecio species

Identifiers

InChI

InChI=1S/C25H36O5/c1-9-16(6)24(28)30-23-19-10-11-20(29-21(26)12-14(2)3)17(7)25(19,8)13-18(15(4)5)22(23)27/h9,12,17-20,23H,4,10-11,13H2,1-3,5-8H3/b16-9+/t17-,18-,19-,20+,23-,25+/m0/s1

0 references

InChIKey

RCRXCWHJSLXPPV-AYUPDJHESA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

RCRXCWHJSLXPPV-AYUPDJHESA-N

(Q105233925)

[(1S,3S,4aR,5R,6R,8aR)-4a,5-dimethyl-6-(3-methylbut-2-enoyloxy)-2-oxo-3-prop-1-en-2-yl-1,3,4,5,6,7,8,8a-octahydronaphthalen-1-yl] (E)-2-methylbut-2-enoate

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)