(Q105284557)

English

[(1S,8R,11R,12S,18R,19R)-14,14,18-trimethyl-9,13,17-trioxo-4,10-dioxatetracyclo[9.7.1.03,7.08,19]nonadeca-3(7),5-dien-12-yl] acetate

chemical compound

In more languages

Statements

type of chemical entity

0 references

1 reference

based on heuristic

inferred from SMILES

14,14,18-trimethyl-9,13,17-trioxo-4,10-dioxatetracyclo[9.7.1.0³,⁷.0⁸,¹⁹]nonadeca-3(7),5-dien-12-yl acetate

1 reference

based on heuristic

inferred from SMILES

402.167853172 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₆O₇

0 references

canonical SMILES

O=C(OC1C(=O)C(C)(C)CCC(=O)C(C)C2CC=3OC=CC3C4C(=O)OC1C42)C

0 references

isomeric SMILES

CC(=O)O[C@@H]1C(=O)C(C)(C)CCC(=O)[C@H](C)[C@H]2Cc3occc3[C@@H]3C(=O)O[C@@H]1[C@H]23

0 references

Caesalpinia minax

1 reference

Structure and antiviral properties of macrocaesalmin, a novel cassane furanoditerpenoid lactone from the seeds of Caesalpinia minax Hance

Guilandina minax

1 reference

Structure and antiviral properties of macrocaesalmin, a novel cassane furanoditerpenoid lactone from the seeds of Caesalpinia minax Hance

Identifiers

InChI=1S/C22H26O7/c1-10-13-9-15-12(6-8-27-15)17-16(13)18(29-21(17)26)19(28-11(2)23)20(25)22(3,4)7-5-14(10)24/h6,8,10,13,16-19H,5,7,9H2,1-4H3/t10-,13-,16-,17+,18-,19+/m1/s1

0 references

VEFFCERDQGCCMJ-YRSWNBETSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

Sitelinks

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