(Q113959916)

English

(E)-4-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-2-(2-ethoxy-2-oxoethyl)but-2-enoic acid

chemical compound

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instance of

type of chemical entity

0 references

1 reference

362.245709568 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₃₄O₄

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canonical SMILES

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

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isomeric SMILES

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

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found in taxon

Wurfbainia villosa

1 reference

stated in

Anti-inflammatory and Glucosidase Inhibitory Activities of Labdane and Norlabdane Diterpenoids from the Rhizomes of Amomum villosum

Identifiers

InChI

InChI=1S/C22H34O4/c1-6-26-19(23)14-16(20(24)25)9-10-17-15(2)8-11-18-21(3,4)12-7-13-22(17,18)5/h9,17-18H,2,6-8,10-14H2,1,3-5H3,(H,24,25)/b16-9+/t17-,18-,22+/m0/s1

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InChIKey

IWADPZYDBFXVRP-OXNXFDESSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

IWADPZYDBFXVRP-OXNXFDESSA-N

1 reference

(Q113959916)

(E)-4-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-2-(2-ethoxy-2-oxoethyl)but-2-enoic acid

Statements

Identifiers

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