agrocin 84

chemical compound

ChemicalSubstance group_of_stereoisomers Q27156375

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agrocin 84

Summary

agrocin 84 is a group of stereoisomers^[1].

Key Facts

agrocin 84's instance of is recorded as group of stereoisomers^[2].
agrocin 84's CAS Registry Number is recorded as 59111-78-3^[3].
agrocin 84's canonical SMILES is recorded as CC(C)C(C(C(=O)NP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3NP(=O)(O)OC4C(C(C(O4)C(CO)O)O)O)O)O)O)O^[4].
agrocin 84's InChI is recorded as InChI=1S/C22H36N6O17P2/c1-7(2)11(31)14(34)20(37)27-46(38,39)42-4-9-12(32)15(35)21(43-9)28-6-25-10-18(23-5-24-19(10)28)26-47(40,41)45-22-16(36)13(33)17(44-22)8(30)3-29/h5-9,11-17,21-22,29-36H,3-4H2,1-2H3,(H2,27,37,38,39)(H2,23,24,26,40,41)/t8-,9-,11-,12-,13-,14+,15-,16-,17+,21-,22?/m1/s1^[5].
agrocin 84's InChIKey is recorded as YNCRAYSPLQSJIP-JHNPATRKSA-N^[6].
agrocin 84's chemical formula is recorded as C₂₂H₃₆N₆O₁₇P₂^[7].
agrocin 84's subclass of is recorded as chemical compound^[8].
agrocin 84's ChemSpider ID is recorded as 34448611^[9].
agrocin 84's PubChem CID is recorded as 86289959^[10].
agrocin 84's ChEBI ID is recorded as 82809^[11].
agrocin 84's isomeric SMILES is recorded as CC(C)C@HO^C@HO">[12].
agrocin 84's Human Metabolome Database ID is recorded as HMDB0030532^[13].
agrocin 84's KNApSAcK ID is recorded as C00018184^[14].
agrocin 84's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+718.161217'}^[15].
agrocin 84's UniChem compound ID is recorded as 81826888^[16].

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Quick Facts

Instance of group of stereoisomers

Subclass of chemical compound

Properties

Canonical smiles CC(C)C(C(C(=O)NP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3NP(=O)(O)OC4C(C(C(O4)C(CO)O)O)O)O)O)O)O

Chemical formula C₂₂H₃₆N₆O₁₇P₂

Imported from wholeness_audit_2026-05-02

Isomeric smiles CC(C)[C@H]([C@@H](C(=O)NP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3NP(=O)(O)OC4[C@@H]([C@H]([C@@H](O4)[C@@H](CO)O)O)O)O)O)O)O

Mass unit: www.wikidata.org, amount: +718.161217

External References (9)

Cas registry number 59111-78-3

Chebi id 82809

Chemspider id 34448611

Human metabolome database id HMDB0030532

Inchi InChI=1S/C22H36N6O17P2/c1-7(2)11(31)14(34)20(37)27-46(38,39)42-4-9-12(32)15(35)21(43-9)28-6-25-10-18(23-5-24-19(10)28)26-47(40,41)45-22-16(36)13(33)17(44-22)8(30)3-29/h5-9,11-17,21-22,29-36H,3-4H2,1-2H3,(H2,27,37,38,39)(H2,23,24,26,40,41)/t8-,9-,11-,12-,13-,14+,15-,16-,17+,21-,22?/m1/s1

Inchikey YNCRAYSPLQSJIP-JHNPATRKSA-N

Knapsack id C00018184

Pubchem cid 86289959

Unichem compound id 81826888

🏷️ Also known as

en Agrocin en agrocin 84

References

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

Direct Wikidata claims

[2] ↑ agrocin 84 — instance of (P31): group of stereoisomers. wikidata.org.
[3] ↑ agrocin 84 — CAS Registry Number (P231): 59111-78-3. ChEBI. Retrieved 2016-10-09. wikidata.org.
[4] ↑ agrocin 84 — canonical SMILES (P233): CC(C)C(C(C(=O)NP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3NP(=O)(O)OC4C(C(C(O4)C(CO)O)O)O)O)O)O)O. PubChem. Retrieved 2016-10-09. wikidata.org.
[5] ↑ agrocin 84 — InChI (P234): InChI=1S/C22H36N6O17P2/c1-7(2)11(31)14(34)20(37)27-46(38,39)42-4-9-12(32)15(35)21(43-9)28-6-25-10-18(23-5-24-19(10)28)26-47(40,41)45-22-16(36)13(33)17(44-22)8(30)3-29/h5-9,11-17,21-22,29-36H,3-4H2,1-2H3,(H2,27,37,38,39)(H2,23,24,26,40,41)/t8-,9-,11-,12-,13-,14+,15-,16-,17+,21-,22?/m1/s1. PubChem. Retrieved 2016-10-09. wikidata.org.
[6] ↑ agrocin 84 — InChIKey (P235): YNCRAYSPLQSJIP-JHNPATRKSA-N. PubChem. Retrieved 2016-10-09. wikidata.org.
[7] ↑ agrocin 84 — chemical formula (P274): C₂₂H₃₆N₆O₁₇P₂. PubChem. Retrieved 2016-10-09. wikidata.org.
[8] ↑ agrocin 84 — subclass of (P279): chemical compound. wikidata.org.
[9] ↑ agrocin 84 — ChemSpider ID (P661): 34448611. Q2311683. Retrieved 2016-10-09. wikidata.org.
[10] ↑ agrocin 84 — PubChem CID (P662): 86289959. PubChem. Retrieved 2016-10-09. wikidata.org.
[11] ↑ agrocin 84 — ChEBI ID (P683): 82809. ChEBI. Retrieved 2016-10-09. wikidata.org.
[12] ↑ agrocin 84 — isomeric SMILES (P2017): CC(C)[C@H]([C@@H](C(=O)NP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3NP(=O)(O)OC4[C@@H]([C@H]([C@@H](O4)[C@@H](CO)O)O)O)O)O)O)O. PubChem. Retrieved 2016-10-09. wikidata.org.
[13] ↑ agrocin 84 — Human Metabolome Database ID (P2057): HMDB0030532. wikidata.org.
[14] ↑ agrocin 84 — KNApSAcK ID (P2064): C00018184. ChEBI. Retrieved 2016-10-09. wikidata.org.
[15] ↑ agrocin 84 — mass (P2067): {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+718.161217'}. PubChem. Retrieved 2016-10-09. wikidata.org.
[16] ↑ agrocin 84 — UniChem compound ID (P11089): 81826888. UniChem. wikidata.org.

Class ancestry

[1] ↑ agrocin 84 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). agrocin 84. Retrieved May 3, 2026, from https://4ort.xyz/entity/agrocin-84

MLA “agrocin 84.” 4ort.xyz Knowledge Graph, 4ort.xyz, 3 May. 2026, https://4ort.xyz/entity/agrocin-84.

BibTeX

@misc{4ortxyz_agrocin-84_2026, author = {{4ort.xyz Knowledge Graph}}, title = {{agrocin 84}}, year = {2026}, url = {https://4ort.xyz/entity/agrocin-84}, note = {Accessed: 2026-05-03}}

LLM prompt

According to 4ort.xyz Knowledge Graph (aggregator of Wikidata, Wikipedia, and authoritative open-data sources): agrocin 84 — https://4ort.xyz/entity/agrocin-84 (retrieved 2026-05-03)

Canonical URL: https://4ort.xyz/entity/agrocin-84 · Last refreshed: May 3, 2026