(Q110189373)

English

(3S,3aR,4S,9aS,9bS)-4,8-dihydroxy-3,6,9-trimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione

chemical compound

In more languages

Statements

type of chemical entity

0 references

guaiane sesquiterpenoid

1 reference

based on heuristic

inferred from SMILES

278.115423676 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₅H₁₈O₅

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canonical SMILES

O=C1C(O)=C(C)C2C1=C(C)CC(O)C3C(C(=O)OC23)C

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isomeric SMILES

CC1=C2C(=O)C(O)=C(C)[C@@H]2[C@@H]2OC(=O)[C@@H](C)[C@@H]2[C@@H](O)C1

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Pelargonium sidoides

1 reference

Fascinating metabolic pools of Pelargonium sidoides and Pelargonium reniforme, traditional and phytomedicinal sources of the herbal medicine Umckaloabo

Identifiers

InChI=1S/C15H18O5/c1-5-4-8(16)10-7(3)15(19)20-14(10)11-6(2)12(17)13(18)9(5)11/h7-8,10-11,14,16-17H,4H2,1-3H3/t7-,8-,10+,11-,14+/m0/s1

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WAYMPCOVWDCPAY-KWJMIJIYSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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