(Q105149297)

English

(2E)-5-[(1S,4aR,5S,8aR)-5-[(acetyloxy)methyl]-5,8a-dimethyl-2-methylidene-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-en-1-yl acetate

chemical compound

In more languages

Statements

type of chemical entity

0 references

[5-[5-(acetyloxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-enyl] acetate

1 reference

based on heuristic

inferred from SMILES

390.277009696 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₄H₃₈O₄

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canonical SMILES

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

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isomeric SMILES

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

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Cryptomeria japonica

1 reference

Labdanes from Cryptomeria japonica

Identifiers

InChI=1S/C24H38O4/c1-17(12-15-27-19(3)25)8-10-21-18(2)9-11-22-23(5,16-28-20(4)26)13-7-14-24(21,22)6/h12,21-22H,2,7-11,13-16H2,1,3-6H3/b17-12+/t21-,22-,23+,24+/m0/s1

0 references

LBHXIQMBWNFUCB-AOYOYUNPSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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