(Q104390255)

English

Iriflorental

chemical compound

In more languages

Statements

type of chemical entity

0 references

2-[4-Hydroxy-3-(hydroxymethyl)-2-(3-hydroxypropyl)-4-methyl-3-[4-methyl-6-(2,2,3-trimethyl-6-methylidenecyclohexyl)hexa-3,5-dienyl]cyclohexylidene]propanal

1 reference

based on heuristic

inferred from SMILES

486.37091008 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Irisgermanical B

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(2Z)-2-[(2R,3S,4S)-4-hydroxy-3-(hydroxymethyl)-2-(3-hydroxypropyl)-4-methyl-3-[(3E,5E)-4-methyl-6-[(1S,3R)-2,2,3-trimethyl-6-methylidenecyclohexyl]hexa-3,5-dienyl]cyclohexylidene]propanal

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₁H₅₀O₄

0 references

canonical SMILES

O=CC(=C1CCC(O)(C)C(CO)(CCC=C(C=CC2C(=C)CCC(C)C2(C)C)C)C1CCCO)C

0 references

isomeric SMILES

C=C1CC[C@H](C)C(C)(C)[C@@H]1/C=C/C(C)=C/CC[C@@]1(CO)[C@H](CCCO)/C(=C(/C)C=O)CC[C@]1(C)O

0 references

2 references

Analysis of constituents ofIris rhizomes. Part II. Simultaneous SFE of irones and iridals fromIris pallida L. rhizomes

Analysis of Constituents ofIrisRhizomes. Part III—Packed Column Supercritical Fluid Chromatography and High Pressure Liquid Chromatography of Iridals from Rhizomes of Iris pallidaL.

Iris x germanica

6 references

Isolation and Structure Determination of the Precursors of a-and y-Irone and Homologous Compounds from Iris pallida and Iris florentina

Localization of iridals in Iris germanica rhizomes

Composition of Iridals, Unusual Triterpenoids from Sword-Lilies, and the Seasonal Dependence of Their Content in Various Parts of Different Iris Species

New piscicidal triterpenes from Iris germanica.

Identification of iridals as piscicidal components of Iridaceous plants and their conformations associated with CD spectra

Cytotoxicity of iridals, triterpenoids from Iris, on human tumor cell lines A2780 and K562.

Identifiers

InChI=1S/C31H50O4/c1-22(12-15-27-23(2)13-14-25(4)29(27,5)6)10-8-17-31(21-34)28(11-9-19-32)26(24(3)20-33)16-18-30(31,7)35/h10,12,15,20,25,27-28,32,34-35H,2,8-9,11,13-14,16-19,21H2,1,3-7H3/b15-12+,22-10+,26-24-/t25-,27+,28+,30-,31+/m0/s1

0 references

MBNLFFHRULJOPH-HLFHJSLSSA-N

0 references

2 references

17 September 2022

based on heuristic

inferred from InChIKey

matched by identifier from

MBNLFFHRULJOPH-HLFHJSLSSA-N

UniChem compound ID

1 reference

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