(Q105003988)

English

2-[(2S,4aR,8R,8aR)-8-hydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid

chemical compound

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instance of

type of chemical entity

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subclass of

2-[(4aR,8R,8aR)-8-hydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid

1 reference

based on heuristic

inferred from SMILES

2-(8-Hydroxy-4a,8-dimethyldecahydro-2-naphthalenyl)acrylic acid

1 reference

based on heuristic

inferred from SMILES

mass

252.172544628 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

2-[(2R,4aR,8R,8aR)-8-hydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid

2 references

based on heuristic

inferred from InChIKey

1 reference

2-[(2R,4aR,8R,8aS)-8-hydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₄O₃

0 references

canonical SMILES

O=C(O)C(=C)C1CCC2(C)CCCC(O)(C)C2C1

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isomeric SMILES

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

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found in taxon

Chiliadenus candicans

1 reference

stated in

Jasonol, a rare tricyclic eudesmane sesquiterpene and six other new sesquiterpenoids from Jasonia candicans

Identifiers

InChI

InChI=1S/C15H24O3/c1-10(13(16)17)11-5-8-14(2)6-4-7-15(3,18)12(14)9-11/h11-12,18H,1,4-9H2,2-3H3,(H,16,17)/t11-,12+,14+,15+/m0/s1

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InChIKey

FXKCXGBBUBCRPU-CTHBEMJXSA-N

0 references

2 references

26 December 2021

matched by identifier from

InChIKey

FXKCXGBBUBCRPU-CTHBEMJXSA-N

1 reference

(Q105003988)

2-[(2S,4aR,8R,8aR)-8-hydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid

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