Cas no 1158845-78-3 (2H,12H-6,12a-Epoxy-2,7a-methanoindolo[2,3-a]quinolizine-14-carboxylic acid, 3-ethylidene-1,3,4,6,7,12b-hexahydro-12-(methoxymethyl)-, methyl ester, (2R,3E,5S,6S,7aR,12aR,12bS,14R)-)

2H,12H-6,12a-Epoxy-2,7a-methanoindolo[2,3-a]quinolizine-14-carboxylic acid, 3-ethylidene-1,3,4,6,7,12b-hexahydro-12-(methoxymethyl)-, methyl ester, (2R,3E,5S,6S,7aR,12aR,12bS,14R)- structure
1158845-78-3 structure
Product Name:2H,12H-6,12a-Epoxy-2,7a-methanoindolo[2,3-a]quinolizine-14-carboxylic acid, 3-ethylidene-1,3,4,6,7,12b-hexahydro-12-(methoxymethyl)-, methyl ester, (2R,3E,5S,6S,7aR,12aR,12bS,14R)-
CAS No:1158845-78-3
MF:C22H26N2O4
MW:382.452846050262
CID:837347
PubChem ID:131844997
Update Time:2025-04-19

2H,12H-6,12a-Epoxy-2,7a-methanoindolo[2,3-a]quinolizine-14-carboxylic acid, 3-ethylidene-1,3,4,6,7,12b-hexahydro-12-(methoxymethyl)-, methyl ester, (2R,3E,5S,6S,7aR,12aR,12bS,14R)- Chemical and Physical Properties

Names and Identifiers

    • 2H,12H-6,12a-Epoxy-2,7a-methanoindolo[2,3-a]quinolizine-14-carboxylic acid, 3-ethylidene-1,3,4,6,7,12b-hexahydro-12-(methoxymethyl)-, methyl ester, (2R,3E,5S,6S,7aR,12aR,12bS,14R)-
    • N1-Methoxymethyl picrinine
    • 2H,12H-6,12a-Epoxy-2,7a-methanoindolo[2,3-a]quinolizine-14-carboxylic acid, 3-ethylidene-1,3,4...
    • [ "" ]
    • AKOS040762090
    • methyl (1R,9R,11S,14E,15R,17S,19R)-14-ethylidene-2-(methoxymethyl)-18-oxa-2,12-diazahexacyclo[9.6.1.19,15.01,9.03,8.012,17]nonadeca-3,5,7-triene-19-carboxylate
    • 1158845-78-3
    • Methyl (2R,6S,7aR,12aR,12bS,14R,E)-3-ethylidene-12-(methoxymethyl)-1,3,4,6,7,12b-hexahydro-2H,12H-6,12a-epoxy-2,7a-methanoindolo[2,3-a]quinolizine-14-carboxylate
    • F92896
    • Inchi: 1S/C22H26N2O4/c1-4-13-11-23-17-9-14(13)19(20(25)27-3)21-10-18(23)28-22(17,21)24(12-26-2)16-8-6-5-7-15(16)21/h4-8,14,17-19H,9-12H2,1-3H3/b13-4-/t14-,17-,18-,19-,21-,22-/m0/s1
    • InChI Key: FGSDKFHHOWCXOD-XALDAAHSSA-N
    • SMILES: O1[C@H]2C[C@@]34C5C=CC=CC=5N(COC)[C@@]13[C@@H]1C[C@@H](/C(=C\C)/CN12)[C@H]4C(=O)OC

Computed Properties

  • Exact Mass: 382.18900
  • Monoisotopic Mass: 382.189
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 28
  • Rotatable Bond Count: 4
  • Complexity: 740
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 51.2A^2
  • XLogP3: 2.2

Experimental Properties

  • Color/Form: Powder
  • PSA: 51.24000
  • LogP: 2.24710

2H,12H-6,12a-Epoxy-2,7a-methanoindolo[2,3-a]quinolizine-14-carboxylic acid, 3-ethylidene-1,3,4,6,7,12b-hexahydro-12-(methoxymethyl)-, methyl ester, (2R,3E,5S,6S,7aR,12aR,12bS,14R)- Pricemore >>

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2H,12H-6,12a-Epoxy-2,7a-methanoindolo[2,3-a]quinolizine-14-carboxylic acid, 3-ethylidene-1,3,4,6,7,12b-hexahydro-12-(methoxymethyl)-, methyl ester, (2R,3E,5S,6S,7aR,12aR,12bS,14R)- Related Literature

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