(Q105329893)

English

[(1S,2R,4S,5R,6S,7S,8R,9S)-4,5-diacetyloxy-7,8-dibenzoyloxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-6-yl]methyl pyridine-3-carboxylate

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

eudesmane sesquiterpenoid

0 references

pyridine alkaloids

0 references

mass

699.267961132 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₉H₄₁NO₁₁

0 references

canonical SMILES

O=C(OCC12C(OC(=O)C)C(OC(=O)C)CC(C)C32OC(C)(C)C(C3)C(OC(=O)C=4C=CC=CC4)C1OC(=O)C=5C=CC=CC5)C=6C=NC=CC6

0 references

isomeric SMILES

CC(=O)O[C@H]1C[C@@H](C)[C@@]23C[C@@H]([C@@H](OC(=O)c4ccccc4)[C@@H](OC(=O)c4ccccc4)[C@]2(COC(=O)c2cccnc2)[C@H]1OC(C)=O)C(C)(C)O3

0 references

found in taxon

Celastrus angulatus

1 reference

stated in

Natural β-Dihydroagarofuran-Type Sesquiterpenoids as Cognition-Enhancing and Neuroprotective Agents from Medicinal Plants of the Genus Celastrus

Identifiers

InChI

InChI=1S/C39H41NO11/c1-23-19-30(47-24(2)41)32(48-25(3)42)38(22-46-34(43)28-17-12-18-40-21-28)33(50-36(45)27-15-10-7-11-16-27)31(29-20-39(23,38)51-37(29,4)5)49-35(44)26-13-8-6-9-14-26/h6-18,21,23,29-33H,19-20,22H2,1-5H3/t23-,29+,30+,31-,32+,33-,38+,39+/m1/s1

0 references

InChIKey

XLDGWIQPEFDDDV-ZVLXBXPZSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q105329893)

[(1S,2R,4S,5R,6S,7S,8R,9S)-4,5-diacetyloxy-7,8-dibenzoyloxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-6-yl]methyl pyridine-3-carboxylate

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)