(Q27151349)

Neogitogenin (English)

(1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,15S,16R,18R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-15,16-diol

8 October 2016

stereoisomer of

2 references

inferred from InChIKey

2 references

inferred from InChIKey

2 references

inferred from InChIKey

(1R,2S,4S,5'R,6R,7R,8R,9S,12S,13S,15S,16R,18R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-15,16-diol

1 reference

(1S,2R,4R,5'R,6R,7S,8R,9S,12R,13S,15R,16R,18S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-15,16-diol

1 reference

(1R,2S,4R,5'S,6R,7R,8S,9S,12S,13S,15S,16S,18R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-15,16-diol

1 reference

1 reference

1 reference

(1R,2S,4S,5'S,6R,7S,8R,9S,12S,13S,15S,16R,18R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-15,16-diol

1 reference

chemical formula

C₂₇H₄₄O₄

1 reference

Neogitogenin (English)

8 October 2016

canonical SMILES

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

1 reference

Neogitogenin (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(C[C@H]([C@@H](C6)O)O)C)C)C)OC1

1 reference

Neogitogenin (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

Kallstroemia maxima

1 reference

Spirostanes of Kallstroemia tribuloides: identification of C-25 epimers in mixture by 13C NMR spectroscopy

Lycianthes biflora

1 reference

2α-Hydroxysoladulcidine from Lycianthes biflora

Yucca schidigera

1 reference

Steroidal constituents of Yucca shidigera plants and tissue cultures

Agave striata

1 reference

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

Chlorophytum inornatum

1 reference

Phytochemistry and antimycobacterial activity of Chlorophytum inornatum

Nothoscordum bivalve var. bivalve

1 reference

Steroid sapogenins from Nothoscordum gramineum var. philippianum and Tristagma uniflorum

Yucca ×schottii

1 reference

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

Kallstroemia tribuloides

1 reference

Spirostanes of Kallstroemia tribuloides: identification of C-25 epimers in mixture by 13C NMR spectroscopy

Tribulus cistoides

1 reference

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

Identifiers

InChI

InChI=1S/C27H44O4/c1-15-7-10-27(30-14-15)16(2)24-23(31-27)12-20-18-6-5-17-11-21(28)22(29)13-26(17,4)19(18)8-9-25(20,24)3/h15-24,28-29H,5-14H2,1-4H3/t15-,16-,17-,18+,19-,20-,21+,22+,23-,24-,25-,26-,27+/m0/s1

1 reference

Neogitogenin (English)

FWCXELAAYFYCSR-HJXRQQMRSA-N

8 October 2016

InChIKey

2 references

Neogitogenin (English)

8 October 2016

ChEBI release 2020-09-01

1 reference

(2alpha,3beta,5alpha,25S)-Spirostan-2,3-diol (English)

8 October 2016

2 references

Neogitogenin (English)

matched by identifier from

8 October 2016

InChIKey

FWCXELAAYFYCSR-HJXRQQMRSA-N

ChEBI ID

80854

mapping relation type

2 references

Neogitogenin (English)

matched by identifier from

8 October 2016

International Chemical Identifier

InChI

InChI=1S/C27H44O4/c1-15-7-10-27(30-14-15)16(2)24-23(31-27)12-20-18-6-5-17-11-21(28)22(29)13-26(17,4)19(18)8-9-25(20,24)3/h15-24,28-29H,5-14H2,1-4H3/t15-,16-,17-,18+,19-,20-,21+,22+,23-,24-,25-,26-,27+/m0/s1

1 reference

1 reference

Neogitogenin (English)