Cas no 3489-06-3 (Spiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4-f]- indolizine]-4'-carboxylic acid,1,2,5',5'a,7',8',10',10'a-octahydro-6- methoxy-1'-methyl-2-oxo-,methyl ester,(1'S,3S,4'aS,5'aR,10'aS)-)

Spiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4-f]- indolizine]-4'-carboxylic acid,1,2,5',5'a,7',8',10',10'a-octahydro-6- methoxy-1'-methyl-2-oxo-,methyl ester,(1'S,3S,4'aS,5'aR,10'aS)- structure
3489-06-3 structure
Product Name:Spiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4-f]- indolizine]-4'-carboxylic acid,1,2,5',5'a,7',8',10',10'a-octahydro-6- methoxy-1'-methyl-2-oxo-,methyl ester,(1'S,3S,4'aS,5'aR,10'aS)-
CAS No:3489-06-3
MF:C22H26N2O5
MW:398.452246189117
CID:308465
PubChem ID:198910
Update Time:2025-04-19

Spiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4-f]- indolizine]-4'-carboxylic acid,1,2,5',5'a,7',8',10',10'a-octahydro-6- methoxy-1'-methyl-2-oxo-,methyl ester,(1'S,3S,4'aS,5'aR,10'aS)- Chemical and Physical Properties

Names and Identifiers

    • Spiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4-f]- indolizine]-4'-carboxylic acid,1,2,5',5'a,7',8',10',10'a-octahydro-6- methoxy-1'-methyl-2-oxo-,methyl ester,(1'S,3S,4'aS,5'aR,10'aS)-
    • Spiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4-f]- indolizine]-4'-carboxylic acid,1,2,5',5'a,7',8',...
    • Spiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4-f]- indolizine]-4'-carboxylic acid,1,2,5',5'a,7',8',10',10'a-octahydro-6- methoxy-1
    • VINERIDINE
    • CTK1I3121
    • isobutyryl iodide
    • Isobutyryljodid
    • isocaboxine-A
    • Propanoyl iodide, 2-methyl-
    • Isocaboxine A
    • Q15088388
    • 7-Epivinerine
    • FORMOSANAN-16-CARBOXYLIC ACID, 11-METHOXY-19-METHYL-2-OXO-, METHYL ESTER, (3.BETA.,7.ALPHA.,19.ALPHA.,20.ALPHA.)-
    • (3beta,7S,20alpha)-11-Methoxy-19alpha-methyl-2-oxoformosanan-16-carboxylic acid methyl ester
    • Formosanan-16-carboxylic acid, 11-methoxy-19-methyl-2-oxo-, methyl ester, (3-beta,7-alpha,19-alpha,20-alpha)-
    • SPIRO(3H-INDOLE-3,6(4AH)-(1H)PYRANO(3,4-F)INDOLIZINE)-4-CARBOXYLIC ACID, 1,2,5,5A,7,8,10,10A-OCTAHYDRO-6-METHOXY-1-METHYL-2-OXO-, METHYL ESTER, (1S-(1.ALPHA.,4A.ALPHA.,5A.BETA.,6.ALPHA.,10A.ALPHA.))-
    • RAK4CV25QT
    • UNII-RAK4CV25QT
    • SPIRO(3H-INDOLE-3,6(4AH)-(1H)PYRANO(3,4-F)INDOLIZINE)-4-CARBOXYLIC ACID, 1,2,5,5A,7,8,10,10A-OCTAHYDRO-6-METHOXY-1-METHYL-2-OXO-, METHYL ESTER, (1S,3S,4AS,5AR,10AS)-
    • 3489-06-3
    • AKOS030495507
    • DTXSID90956365
    • Vineridin
    • methyl (1S,4aS,5aR,6S,10aS)-6'-methoxy-1-methyl-2'-oxospiro[1,4a,5,5a,7,8,10,10a-octahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylate
    • (1'S,3S,4a'S,5a'R,10a'S)-methyl 6-methoxy-1'-methyl-2-oxo-1',4a',5',5a',7',8',10',10a'-octahydrospiro[indoline-3,6'-pyrano[3,4-f]indolizine]-4'-carboxylate
    • Inchi： 1S/C22H26N2O5/c1-12-15-10-24-7-6-22(17-5-4-13(27-2)8-18(17)23-21(22)26)19(24)9-14(15)16(11-29-12)20(25)28-3/h4-5,8,11-12,14-15,19H,6-7,9-10H2,1-3H3,(H,23,26)/t12-,14-,15-,19+,22-/m0/s1
    • InChI Key： SRKHGHLMEDVZRX-PNGOUSOWSA-N
    • SMILES： O1C=C(C(=O)OC)[C@@H]2[C@H]([C@@H]1C)CN1CC[C@@]3(C(NC4C=C(C=CC3=4)OC)=O)[C@H]1C2

Computed Properties

  • Exact Mass: 398.184
  • Monoisotopic Mass: 398.184
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 29
  • Rotatable Bond Count: 3
  • Complexity: 739
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 5
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 77.1A^2
  • XLogP3: 1.6

Experimental Properties

  • Color/Form: Powder
  • Density: 1.33
  • Boiling Point: 578.4°Cat760mmHg
  • Flash Point: 303.6°C
  • Refractive Index: 1.625

Spiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4-f]- indolizine]-4'-carboxylic acid,1,2,5',5'a,7',8',10',10'a-octahydro-6- methoxy-1'-methyl-2-oxo-,methyl ester,(1'S,3S,4'aS,5'aR,10'aS)- Related Literature

Related Categories

3489-06-3 (Spiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4-f]- indolizine]-4'-carboxylic acid,1,2,5',5'a,7',8',10',10'a-octahydro-6- methoxy-1'-methyl-2-oxo-,methyl ester,(1'S,3S,4'aS,5'aR,10'aS)-) Related Products

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