(Q105387087)

English

[(3aS,4S,5S,6E,10E,11aR)-5-acetyloxy-6-formyl-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (2R)-2-methylbutanoate

chemical compound

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No label defined

No description defined

Statements

type of chemical entity

0 references

(5-Acetyloxy-6-formyl-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl) 2-methylbutanoate

1 reference

based on heuristic

inferred from SMILES

404.183503236 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₈O₇

0 references

canonical SMILES

O=CC1=CCCC(=CC2OC(=O)C(=C)C2C(OC(=O)C(C)CC)C1OC(=O)C)C

0 references

isomeric SMILES

C=C1C(=O)O[C@@H]2/C=C(\C)CC/C=C(/C=O)[C@H](OC(C)=O)[C@@H](OC(=O)[C@H](C)CC)[C@@H]12

0 references

Acanthospermum hispidum

1 reference

Germacranolides and a new type of guaianolide from Acanthospermum hispidum

Identifiers

InChI=1S/C22H28O7/c1-6-13(3)21(25)29-20-18-14(4)22(26)28-17(18)10-12(2)8-7-9-16(11-23)19(20)27-15(5)24/h9-11,13,17-20H,4,6-8H2,1-3,5H3/b12-10+,16-9-/t13-,17-,18+,19+,20+/m1/s1

0 references

ZZUJVHJBKCQCFA-ZZOYQSKNSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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