(Q105221752)

English

(1S,2R,4aS,5R,6S,8S,8aS)-5-[2-(furan-3-yl)ethyl]-2,8-dihydroxy-5,6,8a-trimethyl-1,2,3,4,4a,6,7,8-octahydronaphthalene-1-carbaldehyde

chemical compound

In more languages

Statements

type of chemical entity

0 references

5-[2-(Furan-3-yl)ethyl]-2,8-dihydroxy-5,6,8a-trimethyl-1,2,3,4,4a,6,7,8-octahydronaphthalene-1-carbaldehyde

1 reference

based on heuristic

inferred from SMILES

334.21440944 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₀O₄

0 references

canonical SMILES

O=CC1C(O)CCC2C(C)(CCC3=COC=C3)C(C)CC(O)C12C

0 references

isomeric SMILES

C[C@H]1C[C@H](O)[C@]2(C)[C@H](C=O)[C@H](O)CC[C@H]2[C@]1(C)CCc1ccoc1

0 references

1 reference

Nepetanal and nepetanoate: a new diterpene aldehyde and a benzene derivative ester from Nepeta juncea.

Identifiers

InChI=1S/C20H30O4/c1-13-10-18(23)20(3)15(11-21)16(22)4-5-17(20)19(13,2)8-6-14-7-9-24-12-14/h7,9,11-13,15-18,22-23H,4-6,8,10H2,1-3H3/t13-,15+,16+,17-,18-,19+,20+/m0/s1

0 references

QISIBMBISMJJDX-QUFZPANHSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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