(Q104984314)

English

[(1S,2S,4aR,8aS)-4a-methyl-8-methylidene-2-propan-2-yl-1,2,3,4,5,6,7,8a-octahydronaphthalen-1-yl] (E)-2-methylbut-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

(4a-Methyl-8-methylidene-2-propan-2-yl-1,2,3,4,5,6,7,8a-octahydronaphthalen-1-yl) 2-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

304.240230264 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(1S,2S,4aR,8aS)-4a-methyl-8-methylidene-2-propan-2-yl-1,2,3,4,5,6,7,8a-octahydronaphthalen-1-yl] (Z)-2-methylbut-2-enoate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₂O₂

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canonical SMILES

O=C(OC1C2C(=C)CCCC2(C)CCC1C(C)C)C(=CC)C

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isomeric SMILES

C=C1CCC[C@]2(C)CC[C@@H](C(C)C)[C@H](OC(=O)/C(C)=C/C)[C@@H]12

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found in taxon

Senecio rhyncholaenus

1 reference

stated in

Neuartige ester von eremophilen-derivaten aus südafrikanischen Senecio-arten

Senecio variabilis

1 reference

stated in

Further pyrrolizidine alkaloids and furoeremophilanes from Senecio species

Identifiers

InChI

InChI=1S/C20H32O2/c1-7-14(4)19(21)22-18-16(13(2)3)10-12-20(6)11-8-9-15(5)17(18)20/h7,13,16-18H,5,8-12H2,1-4,6H3/b14-7+/t16-,17+,18-,20+/m0/s1

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InChIKey

DLHWPYSSQZPMPN-KZCFPPPNSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DLHWPYSSQZPMPN-KZCFPPPNSA-N

(Q104984314)

[(1S,2S,4aR,8aS)-4a-methyl-8-methylidene-2-propan-2-yl-1,2,3,4,5,6,7,8a-octahydronaphthalen-1-yl] (E)-2-methylbut-2-enoate

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Identifiers

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