(Q105352251)

English

[(3aS,5R,5aR,7R,8aS,9aR)-8a-hydroxy-1,8-dimethylidene-2-oxospiro[4,5a,6,7,9,9a-hexahydro-3aH-azuleno[6,5-b]furan-5,2'-oxirane]-7-yl] propanoate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

4a-hydroxy-3,5-dimethylidene-2-oxo-hexahydro-3aH-spiro[azuleno[6,5-b]furan-8,2'-oxiran]-6-yl propanoate

1 reference

based on heuristic

inferred from SMILES

mass

334.141638424 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₈H₂₂O₆

0 references

canonical SMILES

O=C1OC2CC3(OC3)C4CC(OC(=O)CC)C(=C)C4(O)CC2C1=C

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isomeric SMILES

C=C1C(=O)O[C@H]2C[C@]3(CO3)[C@@H]3C[C@@H](OC(=O)CC)C(=C)[C@]3(O)C[C@H]12

0 references

found in taxon

Arctotis stoechadifolia

1 reference

stated in

Isolation and structures of sesquiterpene lactones: Aerial parts of Arctotis grandis THUNB. species

Arctotis hirsuta

1 reference

stated in

Sesquiterpene lactones from Venidium hirsutum BEROL. species

Identifiers

InChI

InChI=1S/C18H22O6/c1-4-15(19)23-12-5-14-17(8-22-17)7-13-11(9(2)16(20)24-13)6-18(14,21)10(12)3/h11-14,21H,2-8H2,1H3/t11-,12-,13+,14+,17+,18-/m1/s1

0 references

InChIKey

YQKMSHPWAFJUCP-KIWDAEGUSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YQKMSHPWAFJUCP-KIWDAEGUSA-N

(Q105352251)

[(3aS,5R,5aR,7R,8aS,9aR)-8a-hydroxy-1,8-dimethylidene-2-oxospiro[4,5a,6,7,9,9a-hexahydro-3aH-azuleno[6,5-b]furan-5,2'-oxirane]-7-yl] propanoate

Statements

Identifiers

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