(Q105154934)

English

[(3aR,5Z,9Z,11aS)-10-(hydroxymethyl)-3-methylidene-2-oxo-3a,4,7,8,11,11a-hexahydrocyclodeca[b]furan-6-yl]methyl (2S)-2-methyloxirane-2-carboxylate

chemical compound

In more languages

Statements

type of chemical entity

0 references

germacrane sesquiterpenoid

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348.157288488 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(3aR,11aS)-10-(hydroxymethyl)-3-methylidene-2-oxo-3a,4,7,8,11,11a-hexahydrocyclodeca[b]furan-6-yl]methyl (2S)-2-methyloxirane-2-carboxylate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₉H₂₄O₆

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canonical SMILES

O=C1OC2CC(=CCCC(=CCC2C1=C)COC(=O)C3(OC3)C)CO

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isomeric SMILES

C=C1C(=O)O[C@H]2C/C(CO)=C/CC/C(COC(=O)[C@]3(C)CO3)=C/C[C@H]12

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Mikania cordifolia

1 reference

Melampolides from Mikania cordifolia

Identifiers

InChI=1S/C19H24O6/c1-12-15-7-6-13(10-23-18(22)19(2)11-24-19)4-3-5-14(9-20)8-16(15)25-17(12)21/h5-6,15-16,20H,1,3-4,7-11H2,2H3/b13-6-,14-5-/t15-,16+,19+/m1/s1

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LOUNGXZNOZNTTI-ICYYJJMTSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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