(Q105348161)

English

[(4aS,6aS,7S,10aR,11aS,11bR)-6a-hydroxy-4,4,8,11b-tetramethyl-3,9-dioxo-5,6,7,10a,11,11a-hexahydro-4aH-naphtho[2,1-f][1]benzofuran-7-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

(6a-hydroxy-4,4,8,11b-tetramethyl-3,9-dioxo-5,6,7,10a,11,11a-hexahydro-4aH-naphtho[2,1-f][1]benzofuran-7-yl) acetate

1 reference

based on heuristic

inferred from SMILES

mass

388.188588616 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₂H₂₈O₆

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canonical SMILES

O=C1OC2C(=C1C)C(OC(=O)C)C3(O)CCC4C(C(=O)C=CC4(C)C3C2)(C)C

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isomeric SMILES

CC(=O)O[C@H]1C2=C(C)C(=O)O[C@@H]2C[C@@H]2[C@@]1(O)CC[C@@H]1C(C)(C)C(=O)C=C[C@]12C

0 references

found in taxon

Suregada multiflora

2 references

stated in

Stereostructures and molecular conformations of six diterpene lactones from Gelonium multiflorum

stated in

Q115951082

Identifiers

InChI

InChI=1S/C22H28O6/c1-11-17-13(28-19(11)25)10-15-21(5)8-7-16(24)20(3,4)14(21)6-9-22(15,26)18(17)27-12(2)23/h7-8,13-15,18,26H,6,9-10H2,1-5H3/t13-,14-,15+,18+,21-,22+/m1/s1

0 references

InChIKey

YGMPFLMYCKNEEV-FNJLFZHTSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YGMPFLMYCKNEEV-FNJLFZHTSA-N

(Q105348161)

[(4aS,6aS,7S,10aR,11aS,11bR)-6a-hydroxy-4,4,8,11b-tetramethyl-3,9-dioxo-5,6,7,10a,11,11a-hexahydro-4aH-naphtho[2,1-f][1]benzofuran-7-yl] acetate

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