(Q105133957)

English

[(1S,4Z,9S,10S,11Z,14R)-9-hydroxy-1,4,11-trimethyl-7,17-dioxo-15-propan-2-yl-6,18-dioxatricyclo[12.4.0.05,9]octadeca-4,11,15-trien-10-yl] acetate

chemical compound

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instance of

type of chemical entity

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1 reference

(9-Hydroxy-1,4,11-trimethyl-7,17-dioxo-15-propan-2-yl-6,18-dioxatricyclo[12.4.0.05,9]octadeca-4,11,15-trien-10-yl) acetate

1 reference

based on heuristic

inferred from SMILES

mass

432.214803364 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(1R,4E,9S,10S,11Z,14R)-9-hydroxy-1,4,11-trimethyl-7,17-dioxo-15-propan-2-yl-6,18-dioxatricyclo[12.4.0.05,9]octadeca-4,11,15-trien-10-yl] acetate

1 reference

1 reference

[(1S,4E,9S,10R,11Z,14R)-9-hydroxy-1,4,11-trimethyl-7,17-dioxo-15-propan-2-yl-6,18-dioxatricyclo[12.4.0.05,9]octadeca-4,11,15-trien-10-yl] acetate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₄H₃₂O₇

0 references

canonical SMILES

O=C1OC2(C)CCC(=C3OC(=O)CC3(O)C(OC(=O)C)C(=CCC2C(=C1)C(C)C)C)C

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isomeric SMILES

CC(=O)O[C@H]1/C(C)=C\C[C@@H]2C(C(C)C)=CC(=O)O[C@@]2(C)CC/C(C)=C2\OC(=O)C[C@@]21O

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found in taxon

Stachybotrys chartarum

1 reference

stated in

Atranones A-G, from the toxigenic mold Stachybotrys chartarum.

Identifiers

InChI

InChI=1S/C24H32O7/c1-13(2)17-11-19(26)31-23(6)10-9-15(4)22-24(28,12-20(27)30-22)21(29-16(5)25)14(3)7-8-18(17)23/h7,11,13,18,21,28H,8-10,12H2,1-6H3/b14-7-,22-15-/t18-,21+,23+,24+/m1/s1

0 references

InChIKey

JRKKTRKUMGTMCG-PVYYCIMYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JRKKTRKUMGTMCG-PVYYCIMYSA-N

(Q105133957)

[(1S,4Z,9S,10S,11Z,14R)-9-hydroxy-1,4,11-trimethyl-7,17-dioxo-15-propan-2-yl-6,18-dioxatricyclo[12.4.0.05,9]octadeca-4,11,15-trien-10-yl] acetate

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