(Q105347781)

English

(1E,5S,10R,12Z,14S,16R,17S,20R)-16-hydroxy-2,5,13,16-tetramethyl-9-propan-2-yl-6,15,19-trioxatetracyclo[12.5.1.05,10.017,20]icosa-1,8,12-triene-7,18-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

16-Hydroxy-2,5,13,16-tetramethyl-9-propan-2-yl-6,15,19-trioxatetracyclo[12.5.1.05,10.017,20]icosa-1,8,12-triene-7,18-dione

1 reference

based on heuristic

inferred from SMILES

mass

416.219888744 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1E,5S,10R,12E,14R,16R,17S,20R)-16-hydroxy-2,5,13,16-tetramethyl-9-propan-2-yl-6,15,19-trioxatetracyclo[12.5.1.05,10.017,20]icosa-1,8,12-triene-7,18-dione

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1Z,5S,10R,12E,14R,16R,17S,20R)-16-hydroxy-2,5,13,16-tetramethyl-9-propan-2-yl-6,15,19-trioxatetracyclo[12.5.1.05,10.017,20]icosa-1,8,12-triene-7,18-dione

1 reference

1 reference

C₂₄H₃₂O₆

0 references

canonical SMILES

O=C1OC2(C)CCC(=C3OC(=O)C4C3C(OC4(O)C)C(=CCC2C(=C1)C(C)C)C)C

0 references

isomeric SMILES

C/C1=C/C[C@@H]2C(C(C)C)=CC(=O)O[C@@]2(C)CC/C(C)=C2/OC(=O)[C@H]3[C@@H]2[C@@H]1O[C@@]3(C)O

0 references

found in taxon

Stachybotrys chartarum

1 reference

stated in

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

Identifiers

InChI

InChI=1S/C24H32O6/c1-12(2)15-11-17(25)29-23(5)10-9-14(4)20-18-19(22(26)28-20)24(6,27)30-21(18)13(3)7-8-16(15)23/h7,11-12,16,18-19,21,27H,8-10H2,1-6H3/b13-7-,20-14+/t16-,18+,19-,21-,23+,24-/m1/s1

0 references

InChIKey

YFSGXEZLCNEFQI-VRSDLSGASA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YFSGXEZLCNEFQI-VRSDLSGASA-N

(Q105347781)

(1E,5S,10R,12Z,14S,16R,17S,20R)-16-hydroxy-2,5,13,16-tetramethyl-9-propan-2-yl-6,15,19-trioxatetracyclo[12.5.1.05,10.017,20]icosa-1,8,12-triene-7,18-dione

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