(Q27138840)

methyl (2R)-2-[(2R,3Z,12bS)-3-ethylidene-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]-3-hydroxypropanoate

Isositsirikine (English)

7 October 2016

1 reference

1 reference

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₁H₂₆N₂O₃

1 reference

Isositsirikine (English)

7 October 2016

canonical SMILES

CC=C1CN2CCC3=C(C2CC1C(CO)C(=O)OC)NC4=CC=CC=C34

1 reference

Isositsirikine (English)

7 October 2016

isomeric SMILES

C/C=C\1/CN2CCC3=C([C@@H]2C[C@@H]1[C@H](CO)C(=O)OC)NC4=CC=CC=C34

1 reference

Isositsirikine (English)

7 October 2016

found in taxon

Alstonia angustifolia

2 references

Alkaloids from Alstonia angustifolia

Alkaloids from Alstonia angustifolia

Alstonia angustiloba

1 reference

Angustilobine and andranginine type indole alkaloids and an uleine-secovallesamine bisindole alkaloid from Alstonia angustiloba.

Tabernaemontana pachysiphon

1 reference

Antimicrobially active alkaloids from Tabernaemontana pachysiphon

Alstonia macrophylla

1 reference

Unusual spirocyclic macroline alkaloids, nitrogenous derivatives, and a cytotoxic bisindole from Alstonia

Hunteria zeylanica

1 reference

Alkaloids of Hunteria zeylanica

Kopsia griffithii

1 reference

Alkaloids from Kopsia griffithii

Strychnos matopensis

1 reference

Alkaloids from roots of Strychnos matopensis

Tabernaemontana divaricata

1 reference

Biologically active indole and bisindole alkaloids from Tabernaemontana divaricata

Melodinus khasianus

1 reference

Melokhanines A-J, Bioactive Monoterpenoid Indole Alkaloids with Diverse Skeletons from Melodinus khasianus

Alstonia spathulata

1 reference

Strychnan and secoangustilobine A type alkaloids from Alstonia spatulata. Revision of the C-20 configuration of scholaricine

Melodinus cochinchinensis

1 reference

Melokhanines A-J, Bioactive Monoterpenoid Indole Alkaloids with Diverse Skeletons from Melodinus khasianus

Tabernaemontana psorocarpa

1 reference

Tabernaemontana L. (Apocynaceae): A review of its taxonomy, phytochemistry, ethnobotany and pharmacology

Tabernaemontana psychotriifolia

1 reference

Tabernaemontana L. (Apocynaceae): A review of its taxonomy, phytochemistry, ethnobotany and pharmacology

Tabernaemontana cymosa

1 reference

Tabernaemontana L. (Apocynaceae): A review of its taxonomy, phytochemistry, ethnobotany and pharmacology

Identifiers

InChI

InChI=1S/C21H26N2O3/c1-3-13-11-23-9-8-15-14-6-4-5-7-18(14)22-20(15)19(23)10-16(13)17(12-24)21(25)26-2/h3-7,16-17,19,22,24H,8-12H2,1-2H3/b13-3-/t16-,17-,19-/m0/s1

1 reference

Isositsirikine (English)

RGXKJLTVROJBKZ-LZNZQLKFSA-N

7 October 2016

InChIKey

2 references

Isositsirikine (English)

7 October 2016

ChEBI release 2020-09-01

CAS Registry Number

6519-27-3

1 reference

CAS (formerly Chemical Abstracts Service)

25 January 2022

1 reference

Methyl (2R)-2-[(2R,3E,12bS)-3-ethylidene-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-hydroxypropanoate (English)

7 October 2016

2 references

Isositsirikine (English)

matched by identifier from

7 October 2016

InChIKey

RGXKJLTVROJBKZ-LZNZQLKFSA-N

ChEBI ID

70508

mapping relation type

2 references

16R,19E-isositsirikine (English)