Compound Summary
Icariside I
Compound Information
Icariside I
Compound Name: | Icariside I |
Compound CID: | 5745470 |
Synonyms: | Icariside I 56725-99-6 ICARISID I Lcariside I Baohuoside-1 More... |
Iupac Name: | 3,5-dihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one |
InChI: | InChI=1S/C27H30O11/c1-12(2)4-9-15-17(36-27-24(34)22(32)20(30)18(11-28)37-27)10-16(29)19-21(31)23(33)25(38-26(15)19)13-5-7-14(35-3)8-6-13/h4-8,10,18,20,22,24,27-30,32-34H,9,11H2,1-3H3/t18-,20-,22+,24-,27-/m1/s1 |
InChIKey: | IYCPMVXIUPYNHI-WPKKLUCLSA-N |
Canonical Smiles: | CC(=CCC1=C(C=C(C2=C1OC(=C(C2=O)O)C3=CC=C(C=C3)OC)O)OC4C(C(C(C(O4)CO)O)O)O)C |
Isomeric Smiles: | CC(=CCC1=C(C=C(C2=C1OC(=C(C2=O)O)C3=CC=C(C=C3)OC)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)C |
Molecular Weight: | 530.5 |
Molecular Formula: | C27H30O11 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Icariside I
Molecular Weight: | 530.5 |
Molecular Formula: | C27H30O11 |
Hydrogen Bond Donor Count: | 6 |
Hydrogen Bond Acceptor Count: | 11 |
Rotatable Bond Count: | 7 |
Heavy Atom Count: | 38 |
Complexity: | 892 |
Synonyms
Icariside I
| Icariside I | Icariside I |
|---|---|
Icariside I |
56725-99-6 |
ICARISID I |
Lcariside I |
Baohuoside-1 |
3,5-dihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)-7-(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yloxychromen-4-one |
BRN 0072036 |
Icariside-I |
icariside 1 |
Icariin I |
Icariside I; |
C27H30O11 |
3,5,7-Trihydroxy-4-methoxy-8-prenylflavone-3-O-alpha-L-rhamnopranoxide |
4-18-00-03374 (Beilstein Handbook Reference) |
4H-1-Benzopyran-4-one, 3,5-dihydroxy-7-(beta-D-glucopyranosyloxy)-2-(4-methoxyphenyl)-8-(3-methyl-2-butenyl)- |
Anhydroicaritin-7-O-glucoside |
CHEMBL558499 |
SCHEMBL4215872 |
DTXSID30205283 |
HY-N1939 |
MFCD01662755 |
s3247 |
ZINC59764096 |
AKOS016013487 |
AC-34999 |
AS-78068 |
CS-0018250 |
Y0105 |
3,5-Dihydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-buten-1-yl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside |
Experimental Data
Icariside I
| Species | Dose | Unit | Control(Avg days) | Treatment(Avg days) | Avg/Med Lifespan Change(%) | Control(Max days) | Treatment(Max days) | Max Lifespan Change(%) | Significant | Strain | Gender | PubMed | Avg/Med Lifespan Change tab |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 20.000000000000000 | umol/L | 5.180000000000000 | NS | N2 | 33683565 | Inactive |
Experimental Data Visualization
Icariside I
Statistics Data
Icariside I
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 5.180000000000000 | 1 | 1 |
Statistics Data Visualization
Icariside I
