(Q105006871)

English

(1R,5'S,6R,8S,9R,10R,12R)-5'-(furan-3-yl)-6-hydroxy-12-(hydroxymethyl)-10-methylspiro[2-oxatricyclo[6.3.1.04,12]dodec-4-ene-9,3'-oxolane]-2',3-dione

chemical compound

In more languages

Statements

type of chemical entity

0 references

5'-(Furan-3-yl)-6-hydroxy-12-(hydroxymethyl)-10-methylspiro[2-oxatricyclo[6.3.1.04,12]dodec-4-ene-9,3'-oxolane]-2',3-dione

1 reference

based on heuristic

inferred from SMILES

374.136553044 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₂O₇

0 references

canonical SMILES

O=C1OC2CC(C)C3(C(=O)OC(C4=COC=C4)C3)C5CC(O)C=C1C25CO

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isomeric SMILES

C[C@@H]1C[C@H]2OC(=O)C3=C[C@H](O)C[C@H]([C@@]14C[C@@H](c1ccoc1)OC4=O)[C@]32CO

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Teucrium scorodonia

1 reference

Ent-clerodane diterpenoids from six further species of Teucrium

Identifiers

InChI=1S/C20H22O7/c1-10-4-16-20(9-21)13(17(23)27-16)5-12(22)6-15(20)19(10)7-14(26-18(19)24)11-2-3-25-8-11/h2-3,5,8,10,12,14-16,21-22H,4,6-7,9H2,1H3/t10-,12+,14+,15-,16-,19-,20+/m1/s1

0 references

GDPYFBMNTWPGCQ-ONRAPSRNSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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