Compound Summary
Aristolochic acid
Compound Information
Aristolochic acid
Compound Name: | Aristolochic acid |
Compound CID: | 2236 |
Synonyms: | Aristolochic acid Aristolochic acid A 313-67-7 Aristolochic acid I Aristolochin More... |
Iupac Name: | 8-methoxy-6-nitronaphtho[2,1-g][1,3]benzodioxole-5-carboxylic acid |
InChI: | InChI=1S/C17H11NO7/c1-23-12-4-2-3-8-9(12)5-11(18(21)22)14-10(17(19)20)6-13-16(15(8)14)25-7-24-13/h2-6H,7H2,1H3,(H,19,20) |
InChIKey: | BBFQZRXNYIEMAW-UHFFFAOYSA-N |
Canonical Smiles: | COC1=CC=CC2=C3C(=C(C=C21)[N+](=O)[O-])C(=CC4=C3OCO4)C(=O)O |
Isomeric Smiles: | COC1=CC=CC2=C3C(=C(C=C21)[N+](=O)[O-])C(=CC4=C3OCO4)C(=O)O |
Molecular Weight: | 341.27 |
Molecular Formula: | C17H11NO7 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Aristolochic acid
Molecular Weight: | 341.27 |
Molecular Formula: | C17H11NO7 |
Hydrogen Bond Donor Count: | 1 |
Hydrogen Bond Acceptor Count: | 7 |
Rotatable Bond Count: | 2 |
Heavy Atom Count: | 25 |
Complexity: | 550 |
Synonyms
Aristolochic acid
| Aristolochic acid | Aristolochic acid |
|---|---|
Aristolochic acid |
Aristolochic acid A |
313-67-7 |
Aristolochic acid I |
Aristolochin |
Tardolyt |
Aristolochic acid-I |
ARISTOLOCHINE |
TR 1736 |
C17H11NO7 |
NSC11926 |
8-Methoxy-6-nitrophenanthro3,4-d1,3dioxole-5-carboxylic acid |
NSC-50413 |
UNII-94218WFP5T |
NSC50413 |
Birthwort |
3,4-Methylenedioxy-8-methoxy-10-nitro-1-phenanthrenecarboxylic acid |
8-Methoxy-3,4-methylenedioxy-10-nitrophenanthrene-1-carboxylic acid |
8-Methoxy-6-nitrophenanthol (3,4-d) 1,3-dioxole-5-carboxylic acid |
CHEMBL93353 |
MLS002702976 |
CHEBI:2825 |
Aristolochic acid I;TR 1736 |
94218WFP5T |
Phenanthro3,4-d-1,3-dioxole-5-carboxylic acid, 8-methoxy-6-nitro- |
MFCD00004996 |
8-methoxy-6-nitronaphtho2,1-g1,3benzodioxole-5-carboxylic acid |
Phenanthro(3,4-d)-1,3-dioxole-5-carboxylic acid, 8-methoxy-6-nitro- |
Aristolochiazaeure |
8-methoxy-6-nitro-naphtho1,2-e1,3benzodioxole-5-carboxylic acid |
8-METHOXY-6-NITROPHENANTHROL(3,4-D)-1,3-DIOXIDE-5-CARBOXYLIC ACID |
SMR001562128 |
Aristolochic acid 1 |
CCRIS 1544 |
SR-05000002369 |
EINECS 206-238-3 |
NSC 11926 |
NSC 50413 |
BRN 0345159 |
Phenanthro3,3-dioxole-5-carboxylic acid, 8-methoxy-6-nitro- |
aris-tolochic acid |
Aristolochic-acid-A |
Spectrum_001156 |
SpecPlus_000448 |
8-Methoxy-3,4-methylendioxxy-10-nitro-1-phenanthrencarbonsaeure |
Spectrum2_000822 |
Spectrum3_001114 |
Spectrum4_001952 |
Spectrum5_000729 |
Aristolochic acid A,(S) |
ZINC52 |
NCIMech_000812 |
Aristolochic acid I, powder |
BSPBio_001440 |
BSPBio_002848 |
KBioGR_000160 |
KBioGR_002387 |
KBioSS_000160 |
KBioSS_001636 |
MLS002695974 |
DivK1c_006544 |
SCHEMBL166284 |
SPECTRUM1502233 |
SPBio_000743 |
DTXSID0040969 |
KBio1_001488 |
KBio2_000160 |
KBio2_001636 |
KBio2_002728 |
KBio2_004204 |
KBio2_005296 |
KBio2_006772 |
KBio3_000319 |
KBio3_000320 |
KBio3_002068 |
Bio1_000418 |
Bio1_000907 |
Bio1_001396 |
Bio2_000160 |
Bio2_000640 |
HMS1361H22 |
HMS1791H22 |
HMS1989H22 |
HMS3402H22 |
HY-N0510 |
TNP00273 |
8-methoxy-6-nitro-naphtho2,1-g1,3benzodioxole-5-carboxylic acid |
BDBM50306855 |
CCG-35796 |
CCG-36162 |
NSC-11926 |
s9193 |
AKOS015896751 |
MCULE-3861334509 |
IDI1_033910 |
NCGC00017334-01 |
NCGC00017334-02 |
NCGC00017334-03 |
NCGC00017334-04 |
NCGC00017334-05 |
NCGC00017334-06 |
NCGC00017334-07 |
NCGC00095981-01 |
NCGC00095981-02 |
NCGC00095981-03 |
NCGC00095981-04 |
NCGC00095981-05 |
AC-34489 |
BS-16911 |
NCI60_000460 |
ST057179 |
XA167153 |
AB0028965 |
DB-048017 |
CS-0009050 |
FT-0602867 |
N2032 |
ST50307164 |
X1086 |
C08469 |
313A677 |
Q-100394 |
SR-05000002369-2 |
SR-05000002369-3 |
Q21099362 |
Aristolochia, European Pharmacopoeia (EP) Reference Standard |
8-Methoxy-6-nitro-phenanthro3,4-d1,3dioxole-5-carboxylic acid |
Aristolochic acid I, European Pharmacopoeia (EP) Reference Standard |
8-methoxy-6-nitro-2H-phenanthro3,4-d1,3-dioxolene-5-carboxylic acid |
8-methoxy-6-nitro-2H-phenanthro4,3-d1,3-dioxolene-5-carboxylic acid |
8-Methoxy-6-nitrophenanthro3,4-d1,3dioxole-5-carboxylic acid # |
Phenanthro3,4-d-1,3-dioxole-5-carbocylic acid, 8-methoxy-6-nitro- |
GOQ |
Experimental Data
Aristolochic 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Drosophila melanogaster | 20.000000000000000 | umol/L | 54.370000000000000 | 54.040000000000000 | -0.610000000000000 | NS | FEMALES | 33008901 | Inactive | ||||
| Drosophila melanogaster | 200.000000000000000 | umol/L | 46.390000000000000 | 44.670000000000000 | -3.710000000000000 | NS | MALES | 33008901 | Inactive | ||||
| Caenorhabditis elegans | 10.000000000000000 | umol/L | 16.590000000000000 | 9.315000000000000 | -43.860000000000000 | NS | N2 | 33008901 | Inactive | ||||
| Caenorhabditis elegans | 100.000000000000000 | umol/L | 16.800000000000000 | 8.793000000000000 | -47.650000000000000 | NS | N2 | 33008901 | Inactive |
Experimental Data Visualization
Aristolochic acid
Statistics Data
Aristolochic acid
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -43.860000000000000 | 1 | 2 | |
| Drosophila melanogaster | -0.610000000000000 | 1 | 2 |
Statistics Data Visualization
Aristolochic acid
