(Q105218341)

English

[(1S,2R,4S,5R,6S,9S,10S,11S,12S,13R)-2,11,12-trihydroxy-2,6,11-trimethyl-7-oxo-8,14-dioxatetracyclo[8.4.0.01,13.05,9]tetradecan-4-yl] propanoate

chemical compound

In more languages

Statements

type of chemical entity

0 references

(2,11,12-Trihydroxy-2,6,11-trimethyl-7-oxo-8,14-dioxatetracyclo[8.4.0.01,13.05,9]tetradecan-4-yl) propanoate

1 reference

based on heuristic

inferred from SMILES

370.162767792 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₈H₂₆O₈

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canonical SMILES

O=C(OC1CC(O)(C)C23OC3C(O)C(O)(C)C2C4OC(=O)C(C)C14)CC

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isomeric SMILES

CCC(=O)O[C@H]1C[C@@](C)(O)[C@@]23O[C@@H]2[C@H](O)[C@@](C)(O)[C@@H]3[C@H]2OC(=O)[C@@H](C)[C@H]12

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Otanthus maritimus

1 reference

Highly oxygenated guaianolides from Otanthus maritimus

Identifiers

InChI=1S/C18H26O8/c1-5-9(19)24-8-6-16(3,22)18-12(11-10(8)7(2)15(21)25-11)17(4,23)13(20)14(18)26-18/h7-8,10-14,20,22-23H,5-6H2,1-4H3/t7-,8-,10+,11-,12-,13-,14+,16+,17-,18-/m0/s1

0 references

QCMNJCXZZRZEAT-ZIQSQREPSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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