(Q27149805)

Neotigogenin (English)

8 October 2016

2 references

(1R,2R,4S,5'S,6R,7R,8S,9S,12R,13S,16S,18R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-ol

inferred from InChI

2 references

2 references

(1R,2S,4R,5'R,6R,7R,8R,9S,12S,13S,16S,18R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-ol

inferred from InChI

2 references

(1R,2R,4R,5'R,6R,7S,8R,9S,12S,13S,16S,18S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-ol

1 reference

1 reference

1 reference

C₂₇H₄₄O₃

1 reference

Neotigogenin (English)

8 October 2016

canonical SMILES

CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)O)C)C)C)OC1

1 reference

Neotigogenin (English)

8 October 2016

isomeric SMILES

C[C@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@@H]6[C@@]5(CC[C@@H](C6)O)C)C)C)OC1

1 reference

Neotigogenin (English)

Trigonella foenum-graecum

8 October 2016

found in taxon

6 references

Variation in diosgenin levels among 10 accessions of fenugreek seeds produced in western Canada

Microdetermination of diosgenin from fenugreek (Trigonella foenum-graecum) seeds

Accumulation of sterols and steroidal sapogenins in developing fenugreek pods: Possible biosynthesis in situ

Steroid saponins from fenugreek seeds: extraction, purification, and pharmacological investigation on feeding behavior and plasma cholesterol.

Analysis of Steroidal Sapogenins from Amber Fenugreek (Trigonella foenum-graecum) by Capillary Gas Chromatography and Combined Gas Chromatography/Mass Spectrometry†

Minor Steroidal Sapogenins from Fenugreek Seeds, Trigonella foenum-graecum

Cordyline australis

2 references

Steroidal Sapogenins From Leaves of Cordyline Species

Australigenin, a New Steroidal Sapogenin from Cordyline australis Fruits

Cordyline stricta

1 reference

Steroidal Sapogenins From Leaves of Cordyline Species

Tribulus cistoides

1 reference

Cardioactive steroid saponins and other constituents from the aerial parts of Tribulus cistoides

sisal

1 reference

Cytotoxic steroidal saponins from Agave sisalana

Agave striata

1 reference

Steroidal sapogenins; biogenesis of the steroidal sapogenins in Agaves, Manfreda and Hesperaloe

Chlorogalum pomeridianum

1 reference

Saponins and Sapogenins. X. The Isolation of Gitogenin from Chlorogalum Pomeridianum

Yucca ×schottii

1 reference

Steroidal sapogenins; the position of the double bond in yuccagenin and kammogenin

Ipheion uniflorum

2 references

Steroid sapogenins from Nothoscordum gramineum var. philippianum and Tristagma uniflorum

Steroid sapogenins from Tristagma uniflorum

Identifiers

InChI

InChI=1S/C27H44O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h16-24,28H,5-15H2,1-4H3/t16-,17-,18-,19-,20+,21-,22-,23-,24-,25-,26-,27+/m0/s1

1 reference

Neotigogenin (English)

8 October 2016

2 references

Neotigogenin (English)

8 October 2016

ChEBI release 2020-09-01

2 references

Neotigogenin (English)

8 October 2016

https://commonchemistry.cas.org/detail?cas_rn=470-01-9

8 April 2021

1 reference

Tigogenin (English)

8 October 2016

2 references

Neotigogenin (English)

8 October 2016

ChEBI ID

80752

mapping relation type

2 references

Neotigogenin (English)

8 October 2016

International Chemical Identifier

InChI

InChI=1S/C27H44O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h16-24,28H,5-15H2,1-4H3/t16-,17-,18-,19-,20+,21-,22-,23-,24-,25-,26-,27+/m0/s1

1 reference

1 reference

Human Metabolome Database ID

NSC number

232021

0 references

HMDB0030047

2 references

KNApSAcK ID

C00057400

2 references

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

Neotigogenin (English)

8 October 2016

1 reference