Indaconitine

chemical compound

ChemicalSubstance group_of_stereoisomers Q27106926

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Indaconitine

Summary

Indaconitine is a group of stereoisomers^[1].

Key Facts

Indaconitine's instance of is recorded as group of stereoisomers^[2].
Indaconitine's canonical SMILES is recorded as CCN1CC2(C(CC(C34C2C(C(C31)C5(CC(C6(CC4C5C6OC(=O)C7=CC=CC=C7)O)OC)OC(=O)C)OC)OC)O)COC^[3].
Indaconitine's chemical formula is recorded as C₃₄H₄₇NO₁₀^[4].
Indaconitine is a type of aconitane alkaloid^[5].
Indaconitine's found in taxon is recorded as Aconitum vilmorinianum^[6].
Indaconitine's found in taxon is recorded as Aconitum hemsleyanum^[7].
Indaconitine's found in taxon is recorded as Aconitum carmichaelii^[8].
Indaconitine's isomeric SMILES is recorded as CCN1C[C@@]2(C@@HO)COC^{C@@HO)COC">[9]}.
Indaconitine's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+629.319997'}^[10].

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Quick Facts

Instance of group of stereoisomers

Subclass of aconitane alkaloid

Properties

Canonical smiles CCN1CC2(C(CC(C34C2C(C(C31)C5(CC(C6(CC4C5C6OC(=O)C7=CC=CC=C7)O)OC)OC(=O)C)OC)OC)O)COC

Chemical formula C₃₄H₄₇NO₁₀

Found in taxon Aconitum vilmorinianum, Aconitum hemsleyanum, Aconitum carmichaelii

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

Mass +629.319997

External References (11)

Cas registry number 4491-19-4

Chebi id 5890

Chemspider id 390342

Dsstox compound identifier DTXCID401391058

Dsstox substance id DTXSID50963297

Inchi InChI=1S/C34H47NO10/c1-7-35-16-31(17-40-3)21(37)13-22(41-4)34-20-14-32(39)23(42-5)15-33(45-18(2)36,25(28(34)35)26(43-6)27(31)34)24(20)29(32)44-30(38)19-11-9-8-10-12-19/h8-12,20-29,37,39H,7,13-17H2,1-6H3/t20-,21-,22+,23+,24-,25+,26+,27-,28?,29-,31+,32+,33-,34+/m1/s1

Inchikey PHDZNMWTZQPAEW-ZIVNFORMSA-N

Kegg id C08691

Knapsack id C00001647

Pubchem cid 441740

Unichem compound id 1067994

🏷️ Also known as

en Indaconitine

References

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

Direct Wikidata claims

[2] ↑ Indaconitine — instance of (P31): group of stereoisomers. wikidata.org.
[3] ↑ Indaconitine — canonical SMILES (P233): CCN1CC2(C(CC(C34C2C(C(C31)C5(CC(C6(CC4C5C6OC(=O)C7=CC=CC=C7)O)OC)OC(=O)C)OC)OC)O)COC. PubChem. Retrieved 2016-10-05. wikidata.org.
[4] ↑ Indaconitine — chemical formula (P274): C₃₄H₄₇NO₁₀. PubChem. Retrieved 2016-10-05. wikidata.org.
[5] ↑ Indaconitine — subclass of (P279): aconitane alkaloid. wikidata.org.
[6] ↑ Indaconitine — found in taxon (P703): Aconitum vilmorinianum. A diterpenoid alkaloid from Aconitum vilmorinianum var. patentipilum. wikidata.org.
[7] ↑ Indaconitine — found in taxon (P703): Aconitum hemsleyanum. Hemsleyatine, a Novel C19-Diterpenoid Alkaloid with 8-Amino Group from Aconitum hemsleyanum.. wikidata.org.
[8] ↑ Indaconitine — found in taxon (P703): Aconitum carmichaelii. Neutral Fragment Filtering for Rapid Identification of New Diester-Diterpenoid Alkaloids in Roots of Aconitum carmichaeli by Ultra-High-Pressure Liquid Chromatography Coupled with Linear Ion Trap-Orbitrap Mass Spectrometry. wikidata.org.
[9] ↑ Indaconitine — isomeric SMILES (P2017): CCN1C[C@@]2([C@@H](C[C@@H]([C@@]34[C@@H]2[C@H]([C@@H](C31)[C@]5(C[C@@H]([C@]6(C[C@@H]4[C@@H]5[C@H]6OC(=O)C7=CC=CC=C7)O)OC)OC(=O)C)OC)OC)O)COC. PubChem. Retrieved 2016-10-05. wikidata.org.
[10] ↑ Indaconitine — mass (P2067): {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+629.319997'}. PubChem. Retrieved 2016-10-05. wikidata.org.

Class ancestry

[1] ↑ Indaconitine 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). Indaconitine. Retrieved May 3, 2026, from https://4ort.xyz/entity/indaconitine

MLA “Indaconitine.” 4ort.xyz Knowledge Graph, 4ort.xyz, 3 May. 2026, https://4ort.xyz/entity/indaconitine.

BibTeX

@misc{4ortxyz_indaconitine_2026, author = {{4ort.xyz Knowledge Graph}}, title = {{Indaconitine}}, year = {2026}, url = {https://4ort.xyz/entity/indaconitine}, note = {Accessed: 2026-05-03}}

LLM prompt

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

Canonical URL: https://4ort.xyz/entity/indaconitine · 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.

11w ago · Nabbegat · 2026-06-19 view diff on Wikidata ↗

Dsstox substance id → DTXSID50963297

Imported from → —

Kegg id → C08691

Instance of → group of stereoisomers

+ 16 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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