(Q105365677)

English

(4aS,5R,8R,8aR)-8-(2-hydroxypropan-2-yl)-5-methyl-3,4,4a,5,6,7,8,8a-octahydronaphthalene-2-carboxylic acid

chemical compound

In more languages

Statements

type of chemical entity

0 references

8-(2-Hydroxypropan-2-yl)-5-methyl-3,4,4a,5,6,7,8,8a-octahydronaphthalene-2-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

252.172544628 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₅H₂₄O₃

0 references

canonical SMILES

O=C(O)C1=CC2C(CC1)C(C)CCC2C(O)(C)C

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isomeric SMILES

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

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Fabiana imbricata

2 references

The sesquiterpenes of Fabiana imbricata

Sesquiterpenes from Fabiana imbricata

Identifiers

InChI=1S/C15H24O3/c1-9-4-7-13(15(2,3)18)12-8-10(14(16)17)5-6-11(9)12/h8-9,11-13,18H,4-7H2,1-3H3,(H,16,17)/t9-,11+,12+,13-/m1/s1

0 references

YVNQIXNGSFWMAR-LPTSXCQYSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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