(Q105216051)

English

(E)-5-[(1S,4aS,5S,8aS)-5-(acetyloxymethyl)-8a-methyl-2-methylidene-1,3,4,4a,5,6,7,8-octahydronaphthalen-1-yl]-3-methylpent-2-enoic acid

chemical compound

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No label defined

No description defined

Statements

type of chemical entity

0 references

5-[5-(Acetyloxymethyl)-8a-methyl-2-methylidene-1,3,4,4a,5,6,7,8-octahydronaphthalen-1-yl]-3-methylpent-2-enoic acid

1 reference

based on heuristic

inferred from SMILES

348.230059504 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₃₂O₄

0 references

canonical SMILES

O=C(O)C=C(C)CCC1C(=C)CCC2C(COC(=O)C)CCCC12C

0 references

isomeric SMILES

C=C1CC[C@H]2[C@@H](COC(C)=O)CCC[C@]2(C)[C@H]1CC/C(C)=C/C(=O)O

0 references

1 reference

Terpenoids of the oleoresin of Pinus pumila

Identifiers

InChI=1S/C21H32O4/c1-14(12-20(23)24)7-9-18-15(2)8-10-19-17(13-25-16(3)22)6-5-11-21(18,19)4/h12,17-19H,2,5-11,13H2,1,3-4H3,(H,23,24)/b14-12+/t17-,18+,19+,21-/m1/s1

0 references

PWYIITFCWUJCMR-DDZXFPHNSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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