(Q104951457)

English

3-[2-[(1aR,2R,3aR,4S,5R,7aR,7bS)-2-hydroxy-4,5,7a,7b-tetramethyl-2,3,3a,5,6,7-hexahydro-1aH-naphtho[1,2-b]oxiren-4-yl]ethyl]-2H-furan-5-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

3-[2-(2-hydroxy-4,5,7a,7b-tetramethyl-2,3,3a,5,6,7-hexahydro-1aH-naphtho[1,2-b]oxiren-4-yl)ethyl]-2H-furan-5-one

1 reference

based on heuristic

inferred from SMILES

mass

334.21440944 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

3-[2-[(1aS,2S,3aR,4S,5R,7aS,7bR)-2-hydroxy-4,5,7a,7b-tetramethyl-2,3,3a,5,6,7-hexahydro-1aH-naphtho[1,2-b]oxiren-4-yl]ethyl]-2H-furan-5-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₀O₄

0 references

canonical SMILES

O=C1OCC(=C1)CCC2(C)C(C)CCC3(C)C2CC(O)C4OC43C

0 references

isomeric SMILES

C[C@@H]1CC[C@]2(C)[C@H](C[C@@H](O)[C@H]3O[C@]32C)[C@@]1(C)CCC1=CC(=O)OC1

0 references

found in taxon

Symphyopappus compressus

1 reference

stated in

Thirteen kolavane derivatives from Symphyopappus species

Identifiers

InChI

InChI=1S/C20H30O4/c1-12-5-8-19(3)15(10-14(21)17-20(19,4)24-17)18(12,2)7-6-13-9-16(22)23-11-13/h9,12,14-15,17,21H,5-8,10-11H2,1-4H3/t12-,14-,15-,17-,18+,19-,20-/m1/s1

0 references

InChIKey

CALCCCCAVSSODL-OWTWMBPWSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

CALCCCCAVSSODL-OWTWMBPWSA-N

(Q104951457)

3-[2-[(1aR,2R,3aR,4S,5R,7aR,7bS)-2-hydroxy-4,5,7a,7b-tetramethyl-2,3,3a,5,6,7-hexahydro-1aH-naphtho[1,2-b]oxiren-4-yl]ethyl]-2H-furan-5-one

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