(Q105134257)

English

2-[(3S,5S,8S,8aS)-3,8-dimethyl-1,2,3,5,6,7,8,8a-octahydroazulen-5-yl]propan-2-ol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

2-(3,8-Dimethyl-1,2,3,5,6,7,8,8a-octahydroazulen-5-yl)propan-2-ol

1 reference

based on heuristic

inferred from SMILES

mass

222.198365452 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

2-[(3S,5S,8S,8aR)-3,8-dimethyl-1,2,3,5,6,7,8,8a-octahydroazulen-5-yl]propan-2-ol

1 reference

based on heuristic

inferred from InChIKey

2-[(3S,5R,8S,8aS)-3,8-dimethyl-1,2,3,5,6,7,8,8a-octahydroazulen-5-yl]propan-2-ol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₆O

0 references

canonical SMILES

OC(C)(C)C1C=C2C(C)CCC2C(C)CC1

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isomeric SMILES

C[C@H]1CC[C@@H]2C1=C[C@@H](C(C)(C)O)CC[C@@H]2C

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found in taxon

Trilophozia quinquedentata

1 reference

stated in

(−)-7-epi-Isojunenol and (+)-7-epi-junenol, constituents of the liverwort Tritomaria quinquedentata

Tritomaria quinquedentata

1 reference

stated in

(−)-7-epi-Isojunenol and (+)-7-epi-junenol, constituents of the liverwort Tritomaria quinquedentata

Identifiers

InChI

InChI=1S/C15H26O/c1-10-5-7-12(15(3,4)16)9-14-11(2)6-8-13(10)14/h9-13,16H,5-8H2,1-4H3/t10-,11-,12-,13-/m0/s1

0 references

InChIKey

JSCBEOXFGCAOKV-CYDGBPFRSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JSCBEOXFGCAOKV-CYDGBPFRSA-N

(Q105134257)

2-[(3S,5S,8S,8aS)-3,8-dimethyl-1,2,3,5,6,7,8,8a-octahydroazulen-5-yl]propan-2-ol

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