(Q105170741)

English

[(5aR,6R,8S,9S,9aS,9bR)-6,9-dihydroxy-3-(hydroxymethyl)-5a,9-dimethyl-2-oxo-5,6,7,8,9a,9b-hexahydro-4H-benzo[g][1]benzofuran-8-yl] acetate

chemical compound

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instance of

type of chemical entity

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subclass of

6,9-dihydroxy-3-(hydroxymethyl)-5a,9-dimethyl-2-oxo-4H,5H,6H,7H,8H,9aH,9bH-naphtho[1,2-b]furan-8-yl acetate

1 reference

based on heuristic

inferred from SMILES

mass

340.152203108 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₇H₂₄O₇

0 references

canonical SMILES

O=C1OC2C(=C1CO)CCC3(C)C(O)CC(OC(=O)C)C(O)(C)C23

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isomeric SMILES

CC(=O)O[C@H]1C[C@@H](O)[C@]2(C)CCC3=C(CO)C(=O)O[C@@H]3[C@H]2[C@]1(C)O

0 references

found in taxon

Achillea fragrantissima

2 references

stated in

Glaucolides from Achillea fragrantissima

stated in

Glaucolides from Achillea fragrantissima

Identifiers

InChI

InChI=1S/C17H24O7/c1-8(19)23-12-6-11(20)16(2)5-4-9-10(7-18)15(21)24-13(9)14(16)17(12,3)22/h11-14,18,20,22H,4-7H2,1-3H3/t11-,12+,13+,14-,16+,17-/m1/s1

0 references

InChIKey

MRNKTYBWANEKJO-SGXNCSQFSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MRNKTYBWANEKJO-SGXNCSQFSA-N

(Q105170741)

[(5aR,6R,8S,9S,9aS,9bR)-6,9-dihydroxy-3-(hydroxymethyl)-5a,9-dimethyl-2-oxo-5,6,7,8,9a,9b-hexahydro-4H-benzo[g][1]benzofuran-8-yl] acetate

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