Delavaine A

chemical compound

ChemicalSubstance group_of_stereoisomers Q27106361

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Delavaine A

Summary

Delavaine An is a group of stereoisomers^[1].

Key Facts

Delavaine A's instance of is recorded as group of stereoisomers^[2].
Delavaine A's canonical SMILES is recorded as CCN1CC2(CCC(C34C2C(C(C31)(C5(CC(C6CC4C5C6OC)OC)O)O)OC)OC)COC(=O)C7=CC=CC=C7NC(=O)C(C)CC(=O)OC^[3].
Delavaine A's chemical formula is recorded as C₃₈H₅₄N₂O₁₁^[4].
Delavaine An is a type of aconitane alkaloid^[5].
Delavaine A's found in taxon is recorded as Delphinium omeiense^[6].
Delavaine A's found in taxon is recorded as Delphinium potaninii^[7].
Delavaine A's isomeric SMILES is recorded as CCN1C[C@@]2(CCC@@HOC)COC(=O)C7=CC=CC=C7NC(=O)C(C)CC(=O)OC^{C@@HOC)COC(=O)C7=CC=CC=C7NC(=O)C(C)CC(=O)OC">[8]}.
Delavaine A's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+714.372761'}^[9].

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Quick Facts

Instance of group of stereoisomers

Subclass of aconitane alkaloid

Properties

Canonical smiles CCN1CC2(CCC(C34C2C(C(C31)(C5(CC(C6CC4C5C6OC)OC)O)O)OC)OC)COC(=O)C7=CC=CC=C7NC(=O)C(C)CC(=O)OC

Chemical formula C₃₈H₅₄N₂O₁₁

Found in taxon Delphinium omeiense, Delphinium potaninii

Isomeric smiles CCN1C[C@@]2(CC[C@@H]([C@@]34[C@@H]2[C@@H]([C@@](C31)([C@]5(C[C@@H]([C@H]6C[C@@H]4[C@@H]5[C@H]6OC)OC)O)O)OC)OC)COC(=O)C7=CC=CC=C7NC(=O)C(C)CC(=O)OC

Mass +714.372761

External References (12)

Cas registry number 109291-57-8

Chebi id 4377

Chemspider id 390326, 35518540

Dsstox compound identifier DTXCID401340124

Dsstox substance id DTXSID80911084

Inchi InChI=1S/C38H54N2O11/c1-8-40-18-35(19-51-33(43)21-11-9-10-12-24(21)39-32(42)20(2)15-27(41)48-5)14-13-26(47-4)37-23-16-22-25(46-3)17-36(44,28(23)29(22)49-6)38(45,34(37)40)31(50-7)30(35)37/h9-12,20,22-23,25-26,28-31,34,44-45H,8,13-19H2,1-7H3,(H,39,42)/t20?,22-,23-,25+,26+,28-,29+,30-,31+,34?,35+,36-,37+,38-/m1/s1

Inchikey JCUPDVBWNHFOAD-LVBPXUMQSA-N

Kegg id C08674

Knapsack id C00001630

Pubchem cid 441723

Surechembl id 30752806

Unichem compound id 1068423

🏷️ Also known as

en Delavaine A

References

Programmatic citations — every numbered marker resolves to a verifiable graph row below.

Direct Wikidata claims

[2] ↑ Delavaine A — instance of (P31): group of stereoisomers. wikidata.org.
[3] ↑ Delavaine A — canonical SMILES (P233): CCN1CC2(CCC(C34C2C(C(C31)(C5(CC(C6CC4C5C6OC)OC)O)O)OC)OC)COC(=O)C7=CC=CC=C7NC(=O)C(C)CC(=O)OC. PubChem. Retrieved 2016-10-05. wikidata.org.
[4] ↑ Delavaine A — chemical formula (P274): C₃₈H₅₄N₂O₁₁. PubChem. Retrieved 2016-10-05. wikidata.org.
[5] ↑ Delavaine A — subclass of (P279): aconitane alkaloid. wikidata.org.
[6] ↑ Delavaine A — found in taxon (P703): Delphinium omeiense. Alkaloidal constituents of Fumaria indica. wikidata.org.
[7] ↑ Delavaine A — found in taxon (P703): Delphinium potaninii. Norditerpenoid alkaloids from Delphinium nordhagenii.. wikidata.org.
[8] ↑ Delavaine A — isomeric SMILES (P2017): CCN1C[C@@]2(CC[C@@H]([C@@]34[C@@H]2[C@@H]([C@@](C31)([C@]5(C[C@@H]([C@H]6C[C@@H]4[C@@H]5[C@H]6OC)OC)O)O)OC)OC)COC(=O)C7=CC=CC=C7NC(=O)C(C)CC(=O)OC. PubChem. Retrieved 2016-10-05. wikidata.org.
[9] ↑ Delavaine A — mass (P2067): {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+714.372761'}. PubChem. Retrieved 2016-10-05. wikidata.org.

Class ancestry

[1] ↑ Delavaine A is an instance of group of stereoisomers (Q59199015) [P31, primary]. Wikidata. wikidata.org.

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Use these citations when quoting this entity in research, articles, AI prompts, or wherever provenance matters. We aggregate Wikidata + Wikipedia + authoritative open-data sources; the stitched, scored, cross-referenced view is what 4ort.xyz contributes.

APA 4ort.xyz Knowledge Graph. (2026). Delavaine A. Retrieved May 3, 2026, from https://4ort.xyz/entity/delavaine-a

MLA “Delavaine A.” 4ort.xyz Knowledge Graph, 4ort.xyz, 3 May. 2026, https://4ort.xyz/entity/delavaine-a.

BibTeX

@misc{4ortxyz_delavaine-a_2026, author = {{4ort.xyz Knowledge Graph}}, title = {{Delavaine A}}, year = {2026}, url = {https://4ort.xyz/entity/delavaine-a}, note = {Accessed: 2026-05-03}}

LLM prompt

According to 4ort.xyz Knowledge Graph (aggregator of Wikidata, Wikipedia, and authoritative open-data sources): Delavaine A — https://4ort.xyz/entity/delavaine-a (retrieved 2026-05-03)

Canonical URL: https://4ort.xyz/entity/delavaine-a · Last refreshed: May 3, 2026

Edit History

Rolling log of changes to this entity's Wikidata record. Values shown reflect the current state of each edited property — follow the history link to see the precise diff for any edit.

12w ago · Nabbegat · 2026-06-19 view diff on Wikidata ↗

Dsstox substance id → DTXSID80911084

Imported from → —

Kegg id → C08674

Instance of → group of stereoisomers

+ 17 other properties edited (see Wikidata diff for full list)

"/* wbeditentity-update-languages-short:0||tr */ QuickStatements 3.0 [[:toollabs:qs-dev/batch/37300|batch #37300]]"

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