Compound Summary
Vanillylmandelic acid
Compound Information
Vanillylmandelic acid
Compound Name: | Vanillylmandelic acid |
Compound CID: | 1245 |
Synonyms: | Vanillylmandelic acid 55-10-7 dl-4-Hydroxy-3-methoxymandelic acid 2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetic acid 4-HYDROXY-3-METHOXYMANDELIC ACID More... |
Iupac Name: | 2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetic acid |
InChI: | InChI=1S/C9H10O5/c1-14-7-4-5(2-3-6(7)10)8(11)9(12)13/h2-4,8,10-11H,1H3,(H,12,13) |
InChIKey: | CGQCWMIAEPEHNQ-UHFFFAOYSA-N |
Canonical Smiles: | COC1=C(C=CC(=C1)C(C(=O)O)O)O |
Isomeric Smiles: | COC1=C(C=CC(=C1)C(C(=O)O)O)O |
Molecular Weight: | 198.17 |
Molecular Formula: | C9H10O5 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Vanillylmandelic acid
Molecular Weight: | 198.17 |
Molecular Formula: | C9H10O5 |
Hydrogen Bond Donor Count: | 3 |
Hydrogen Bond Acceptor Count: | 5 |
Rotatable Bond Count: | 3 |
Heavy Atom Count: | 14 |
Complexity: | 205 |
Synonyms
Vanillylmandelic acid
| Vanillylmandelic acid | Vanillylmandelic acid |
|---|---|
Vanillylmandelic acid |
55-10-7 |
dl-4-Hydroxy-3-methoxymandelic acid |
2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetic acid |
4-HYDROXY-3-METHOXYMANDELIC ACID |
Vanilmandelic acid |
2394-20-9 |
(+/-)-Vanillylmandelic acid |
Benzeneacetic acid, .alpha.,4-dihydroxy-3-methoxy- |
DL-vanillylmandelic acid |
Hydroxy(4-hydroxy-3-methoxyphenyl)acetic acid |
3-Methoxy-4-hydroxymandelate |
VMA |
Adrenaline Related Compound 2 |
CHEBI:20106 |
Vanillomandelic acid |
HMMA |
Mandelic acid, 4-hydroxy-3-methoxy- |
3-methoxy-4-hydroxymandelic acid |
Vanillinmandelic Acid |
DL-vanillomandelic acid |
4-Hydroxy-3-methoxymandelate |
4-Hydroxy-3-methoxymandelic acid |
dl-3-Methoxy-4-hydroxymandelic acid |
4-Hydroxy-3-methoxy-DL-mandelic acid |
(4-Hydroxy-3-methoxyphenyl)glycolic acid |
Benzeneacetic acid, alpha,4-dihydroxy-3-methoxy- |
EINECS 200-224-0 |
3-Methoxy-4-hydroxyphenylhydroxyacetic acid |
MFCD00004235 |
(y)-Vanillylmandelic acid |
(?)-Vanillylmandelic acid |
Lopac0_000602 |
Oprea1_553862 |
MLS002153465 |
SCHEMBL134326 |
(.+/-.)-Vanilmandelic acid |
GTPL6645 |
CHEMBL1256396 |
SCHEMBL10085823 |
DTXSID10861583 |
HMS2235H06 |
HMS3261J06 |
HMS3371D20 |
BCP33203 |
Tox21_500602 |
8088AF |
SBB017532 |
STL558222 |
4-hydroxy-3-methoxyphenylglycolic acid |
AKOS015851906 |
CCG-204691 |
LP00602 |
MCULE-9059916420 |
SDCCGSBI-0050584.P002 |
VC30856 |
NCGC00015492-02 |
NCGC00015492-03 |
NCGC00015492-04 |
NCGC00015492-05 |
NCGC00015492-07 |
NCGC00093978-01 |
NCGC00093978-02 |
NCGC00093978-03 |
NCGC00261287-01 |
AS-62192 |
SMR001230822 |
ST088606 |
DB-071947 |
EU-0100602 |
FT-0634243 |
FT-0669752 |
FT-0669753 |
H0268 |
S6613 |
( inverted question mark)-Vanillylmandelic acid |
C05584 |
D90829 |
H 0131 |
H-6500 |
Hydroxy(4-hydroxy-3-methoxyphenyl)acetic acid # |
055H107 |
A817001 |
dl-.alpha.,4-Dihydroxy-3-methoxyphenylacetic acid |
Q901369 |
SR-01000075241 |
2-(4-Hydroxy-3-methoxyphenyl)-2-hydroxyacetic acid |
SR-01000075241-1 |
2-(4-Hydroxy-3-methoxyphenyl) 2-hydroxyethanoic acid" |
2-(4-hydroxy-3-methoxyphenyl)-2-hydroxyethanoic acid |
DCD57880-FBEE-4ED4-A834-92387D266E8A |
DL-4-Hydroxy-3-methoxymandelic acid, analytical standard |
( inverted question mark)-4-Hydroxy-3-methoxymandelic acid |
Adrenaline Related Compound 2;4-Hydroxy-3-methoxymandelic acid |
DL-4-Hydroxy-3-methoxymandelic acid, >=98% (TLC), powder |
4-Hydroxy-3-methoxy-DL-mandelic acid;2-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)acetic acid |
(+\\-)-4-Hydroxy-3-methoxymandelic Acid-D3 (ring-D3) solution, 100 mug/mL in methanol, ampule of 1 mL, certified reference material |
Experimental Data
Vanillylmandelic acid
| 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 | 33.000000000000000 | umol/L | -2.000000000000000 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
Vanillylmandelic acid
Statistics Data
Vanillylmandelic acid
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -2.000000000000000 | 1 | 1 |
Statistics Data Visualization
Vanillylmandelic acid
