(Q105275396)

English

(E)-5-[(1R,4aS,5R,8aS)-5-(acetyloxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-enoic acid

chemical compound

In more languages

default values for all languages

No label defined

No description defined

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-enoic acid

1 reference

based on heuristic

inferred from SMILES

362.245709568 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(E)-5-[(1S,4aR,5R,8aR)-5-(acetyloxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-enoic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₂H₃₄O₄

0 references

canonical SMILES

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

0 references

isomeric SMILES

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

0 references

Chrysocephalum ambiguum

1 reference

Ent-labdanes, manoyloxide and helipterol derivatives from Chrysocephalum ambiguum

Leiocarpa semicalva

1 reference

Ent-labdanes, manoyloxide and helipterol derivatives from Chrysocephalum ambiguum

Identifiers

InChI=1S/C22H34O4/c1-15(13-20(24)25)7-9-18-16(2)8-10-19-21(4,14-26-17(3)23)11-6-12-22(18,19)5/h13,18-19H,2,6-12,14H2,1,3-5H3,(H,24,25)/b15-13+/t18-,19-,21+,22+/m1/s1

0 references

ULWOIBVJYLRVQJ-RDTJIEFLSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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