Compound Summary

mycophenolic acid
  Compound Information
 mycophenolic acid

Compound Name:

mycophenolic acid

Compound CID:

446541

Synonyms:

mycophenolic acid

24280-93-1

Mycophenolate

Melbex

Myfortic

More...

Iupac Name:

(E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoic acid

InChI:

InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)/b9-4+

InChIKey:

HPNSFSBZBAHARI-RUDMXATFSA-N

Canonical Smiles:

CC1=C2COC(=O)C2=C(C(=C1OC)CC=C(C)CCC(=O)O)O

Isomeric Smiles:

CC1=C2COC(=O)C2=C(C(=C1OC)C/C=C(\C)/CCC(=O)O)O

Molecular Weight:

320.3

Molecular Formula:

C17H20O6

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 mycophenolic acid

Molecular Weight:

320.3

Molecular Formula:

C17H20O6

Hydrogen Bond Donor Count:

2

Hydrogen Bond Acceptor Count:

6

Rotatable Bond Count:

6

Heavy Atom Count:

23

Complexity:

486

  Synonyms
 mycophenolic acid

mycophenolic acid mycophenolic acid

mycophenolic acid

24280-93-1

Mycophenolate

Melbex

Myfortic

Mycophenolsaeure

Lilly-68618

6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-4-hexenoic acid

483-60-3

Acido micofenolico

Micofenolico acido

NSC-129185

Acide mycophenolique

Acidum mycophenolicum

(4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoic acid

CCRIS 5565

NSC 129185

UNII-HU9DX48N0T

(E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoic acid

Ly 68618

(E)-6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-4-hexenoic acid

(E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydroisobenzofuran-5-yl)-4-methylhex-4-enoic acid

6-(1,3-Dihydro-7-hydroxy-5-methoxy-4-methyl-1-oxoisobenzofuran-6-yl)-4-methyl-4-hexanoic acid

MFCD00036814

Lilly 68618

CHEMBL866

HU9DX48N0T

CHEBI:168396

TNP00198

RS-61443 AS MOFETIL

NSC129185

4-Hexenoic acid, 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-, (E)-

4-Methyl-5-methoxy-7-hydroxy-6-(5-carboxy-3-methylpent-2-en-1-yl)-phthalide (E)-

6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-4-hexenoic acid (E)-

4-Hexenoic acid, 6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-, (E)-

NCGC00016786-01

CAS-24280-93-1

6-(1,3-Dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methylhex-4-enoic acid

DSSTox_CID_21070

DSSTox_RID_79619

DSSTox_GSID_41070

(E)-6-(1,3-Dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-4-hexenoic acid

Mycophenolic acid-d3 solution

Mycophenoic acid

Micofenolico acido Spanish

(4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxohydroisobenzofuran-5-yl)-4-methylhex -4-enoic acid

6-(1,3-Dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-4-hexenoic acid

MOA

SMR000471887

Acido micofenolico INN-Spanish

Acide mycophenolique INN-French

Acidum mycophenolicum INN-Latin

SR-01000597602

EINECS 246-119-3

mycophenolic-acid

6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid

Prestwick_817

EINECS 207-595-8

Mycophenolic acid USAN:INN:BAN

Tocris-1505

(Z)-Mycophenolic Acid

1jr1

Mycophenolic acid (TN)

Prestwick2_000556

Prestwick3_000556

Spectrum5_001654

Mycophenolic Acid (MPA)

Mycophenolic acid solution

UPCMLD-DP028

4-Hexenoic acid, (E)-

EC 246-119-3

Mycophenolate;RS-61443

SCHEMBL4549

Mycophenolic (Mycophenolate)

Mycophenolic acid, >=98%

BSPBio_000631

BSPBio_002534

MLS001074701

MLS002222265

MLS002695945

BIDD:GT0456

SPECTRUM1500674

BPBio1_000695

GTPL6832

MEGxm0_000120

Mycophenolic acid (USAN/INN)

Myfortic (mycophenolate sodium)

SCHEMBL2514376

ZINC1758

DTXSID4041070

UPCMLD-DP028:001

ACon0_000960

ACon1_000496

BDBM19264

CHEBI:92545

HMS500H08

AOB5506

EX-A975

HMS1569P13

HMS1921A18

HMS2089A17

HMS2092G22

HMS2096P13

HMS2268H22

HMS3403P09

HMS3412F09

HMS3676F09

Pharmakon1600-01500674

ACT02623

AMY40494

BCP05321

HY-B0421

Tox21_110610

BBL034696

CCG-39914

NSC757424

s2487

STL419986

Mycophenolic acid, analytical standard

AKOS015888214

Tox21_110610_1

AC-4491

BCP9000970

DB01024

DS-1638

MCULE-1991681277

NSC-757424

SDCCGMLS-0066618.P001

(E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid

IDI1_000146

NCGC00016786-02

NCGC00016786-03

NCGC00016786-04

NCGC00016786-05

NCGC00016786-06

NCGC00016786-07

NCGC00016786-08

NCGC00016786-09

NCGC00016786-10

NCGC00016786-11

NCGC00016786-12

NCGC00016786-15

NCGC00025190-01

NCGC00025190-02

NCGC00025190-03

NCGC00025190-04

NCGC00025190-05

NCGC00025190-07

NCGC00025190-08

NCGC00025190-09

NCGC00025190-10

4-Hexenoic acid, 6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-, (4E)-

BM164624

ST044516

Mycophenolic Acid - CAS 24280-93-1

SBI-0051945.P003

AB0011511

A-249

M2216

SW196951-2

C20380

D05096

M 5255

M02087

AB00052466-13

AB00052466-14

AB00052466_15

AB00052466_16

Mycophenolic acid 100 microg/mL in Acetonitrile

280M931

A817192

Mycophenolate mofetil impurity, mycophenolic acid-

Q420553

SR-01000597602-1

SR-01000597602-3

SR-01000597602-4

BRD-K63750851-001-06-6

BRD-K63750851-001-13-2

Mycophenolic acid, powder, BioReagent, suitable for cell culture, >=98%

6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthanlanyl)-4-methyl-4-hexanoic acid

(4E)-6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydroisobenzofuran-5-yl)-4-methylhex-4-enoic Acid (Mycophenolic Acid)

(E)-6-(1,3-dihydro-4-hydroxy-6- methoxy-7-methyl-3-oxoisobenzofuran-5-yl)-4-methyl-4-hexenoic acid

(E)-6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxoisobenzofuran-5-yl)-4-methyl-4-hexenoic acid

1162256-90-7

4-Hexenoic acid, 6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-, (4E)- (9CI)

4-Hexenoic acid, 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-, (E)- (8CI)

4-Hexenoic acid,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5- isobenzofuranyl)-4-methyl-, (E)-

4-Hexenoic acid,6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-, (4E)-

4-Methyl-6-3-oxo-7-methyl-4-hydroxy-6-methoxy-1,3-dihydroisobenzofuran-5-yl-4-hexenoic acid

6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydroisobenzofuran-5-yl)-4-methylhex-4-enoic acid

E-6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-4-hexenoic acid

Mycophenolic acid solution, 1.0 mg/mL in acetonitrile, ampule of 1 mL, certified reference material
  Experimental Data
 mycophenolic 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 10.000000000000000 umol/L 17.010000000000000 17.050000000000000 0.238100000000000 NS N2 33008901 Inactive
Drosophila melanogaster 200.000000000000000 umol/L 43.170000000000000 45.790000000000000 6.085000000000000 NS MALES 33008901 Inactive
Drosophila melanogaster 20.000000000000000 umol/L 44.630000000000000 50.740000000000000 13.700000000000000 S FEMALES 33008901 Active
Caenorhabditis elegans 100.000000000000000 umol/L 15.780000000000000 15.900000000000000 0.820700000000000 NS N2 33008901 Inactive
Saccharomyces cerevisiae 10.000000000000000 mg/L 23.390000000000000 28.560000000000000 0.220000000000000 S BY4741 32232569 Active
  Experimental Data Visualization
 mycophenolic acid

  Statistics Data
 mycophenolic acid

Species Avg/Med Lifespan Change(%) Max Lifespan Change(%) Count Reference Count Data point
Caenorhabditis elegans 0.820700000000000 1 2
Drosophila melanogaster 13.700000000000000 1 2
Saccharomyces cerevisiae 0.220000000000000 1 1
  Statistics Data Visualization
 mycophenolic acid

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