(Q105299143)

English

(3R,3aS,8aS)-8a-methyl-8-oxo-3-propan-2-yl-1,2,3,3a,6,7-hexahydroazulene-5-carbaldehyde

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

3-isopropyl-8a-methyl-8-oxo-1,2,3,3a,6,7-hexahydroazulene-5-carbaldehyde

1 reference

based on heuristic

inferred from SMILES

mass

234.161979944 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3S,3aR,8aR)-8a-methyl-8-oxo-3-propan-2-yl-1,2,3,3a,6,7-hexahydroazulene-5-carbaldehyde

1 reference

based on heuristic

inferred from InChI

(3r,3Ar,8as)-3-isopropyl-8a-methyl-8-oxo-1,2,3,3a,6,7,8,8a-octahydroazulene-5-carbaldehyde

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₂O₂

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canonical SMILES

O=CC1=CC2C(CCC2(C(=O)CC1)C)C(C)C

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isomeric SMILES

CC(C)[C@H]1CC[C@]2(C)C(=O)CCC(C=O)=C[C@H]12

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found in taxon

Achillea ligustica

1 reference

stated in

A new guaianolide and other constituents from Achillea ligustica

Aglaia perviridis

1 reference

stated in

Bioactive flavaglines and other constituents isolated from Aglaia perviridis

Identifiers

InChI

InChI=1S/C15H22O2/c1-10(2)12-6-7-15(3)13(12)8-11(9-16)4-5-14(15)17/h8-10,12-13H,4-7H2,1-3H3/t12-,13-,15+/m1/s1

0 references

InChIKey

VYPYFZUEGQREKP-NFAWXSAZSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VYPYFZUEGQREKP-NFAWXSAZSA-N

1 reference

(Q105299143)

(3R,3aS,8aS)-8a-methyl-8-oxo-3-propan-2-yl-1,2,3,3a,6,7-hexahydroazulene-5-carbaldehyde

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Identifiers

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