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Beta carbolines

Description:

Compounds containing a 9H-pyrido[3,4-b]indole moiety.
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  1. cis-ent-Tadalafil
      Grade & Purity: 
    • ≥98%
    Cas Number: 171596-28-4        Compound CID:  9865139
    IUPAC Name:  (2S,8R)-2-(1,3-benzodioxol-5-yl)-6-methyl-3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraene-4,7-dione
    SMILES:  CN1CC(=O)N2C(C1=O)CC3=C(C2C4=CC5=C(C=C4)OCO5)NC6=CC=CC=C36
    InChIKey: WOXKDUGGOYFFRN-IERDGZPVSA-N
    InChI:  InChI=1S/C22H19N3O4/c1-24-10-19(26)25-16(22(24)27)9-14-13-4-2-3-5-15(13)23-20(14)21(25)12-6-7-17-18(8-12)29-11-28-17/h2-8,16,21,23H,9-11H2,1H3/t16-,21show more
  2. Strictosamide
      Grade & Purity: 
    • ≥98%
    Cas Number: 23141-25-5        Compound CID:  10345799
    IUPAC Name:  (1S,18S,19R,20S)-19-ethenyl-18-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,10.04,9.015,20]show more
    SMILES:  C=CC1C2CC3C4=C(CCN3C(=O)C2=COC1OC5C(C(C(C(O5)CO)O)O)O)C6=CC=CC=C6N4
    InChIKey: LBRPLJCNRZUXLS-IUNANRIWSA-N
    InChI:  InChI=1S/C26H30N2O8/c1-2-12-15-9-18-20-14(13-5-3-4-6-17(13)27-20)7-8-28(18)24(33)16(15)11-34-25(12)36-26-23(32)22(31)21(30)19(10-29)35-26/h2-6,11-12,1show more
  3. 1-(tert-Butoxycarbonyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
      Grade & Purity: 
    • ≥95%
    Cas Number: 123910-26-9        Compound CID:  1268156
    Formula:  C17H20N2O4        Molecular Weight: 316.36
    IUPAC Name:  (3R)-2-[(2-methylpropan-2-yl)oxycarbonyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid
    SMILES:  CC(C)(C)OC(=O)N1CC2=C(CC1C(=O)O)C3=CC=CC=C3N2
    InChIKey: FHEPEWKHTOVVAT-CQSZACIVSA-N
    InChI:  InChI=1S/C17H20N2O4/c1-17(2,3)23-16(22)19-9-13-11(8-14(19)15(20)21)10-6-4-5-7-12(10)18-13/h4-7,14,18H,8-9H2,1-3H3,(H,20,21)/t14-/m1/s1
  4. 9H-Pyrido[3,4-b]indole-3-carbonitrile
      Grade & Purity: 
    • ≥95%
    Cas Number: 83911-48-2        Compound CID:  20059982
    IUPAC Name:  9H-pyrido[3,4-b]indole-3-carbonitrile
    SMILES:  C1=CC=C2C(=C1)C3=C(N2)C=NC(=C3)C#N
    InChIKey: RYLDZJANGRBUGW-UHFFFAOYSA-N
    InChI:  InChI=1S/C12H7N3/c13-6-8-5-10-9-3-1-2-4-11(9)15-12(10)7-14-8/h1-5,7,15H
  5. 6-Chloro-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
      Grade & Purity: 
    • ≥97%
    Cas Number: 23046-68-6        Compound CID:  3159695
    Formula:  C11H11ClN2        Molecular Weight: 206.67
    IUPAC Name:  6-chloro-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
    SMILES:  C1CNCC2=C1C3=C(N2)C=CC(=C3)Cl
    InChIKey: SXHJWBRJNQZWBI-UHFFFAOYSA-N
    InChI:  InChI=1S/C11H11ClN2/c12-7-1-2-10-9(5-7)8-3-4-13-6-11(8)14-10/h1-2,5,13-14H,3-4,6H2
  6. Methyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
      Grade & Purity: 
    • ≥97%
    Cas Number: 16253-64-8        Compound CID:  177728
    Formula:  C13H14N2O2        Molecular Weight: 230.26
    IUPAC Name:  methyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
    SMILES:  COC(=O)C1CC2=C(CN1)NC3=CC=CC=C23
    InChIKey: QZGCHMZBGHVZFB-UHFFFAOYSA-N
    InChI:  InChI=1S/C13H14N2O2/c1-17-13(16)11-6-9-8-4-2-3-5-10(8)15-12(9)7-14-11/h2-5,11,14-15H,6-7H2,1H3
  7. tert-Butyl 9H-pyrido[3,4-b]indole-3-carboxylate
      Grade & Purity: 
    • ≥95%
    Cas Number: 93835-05-3        Compound CID:  124514
    Formula:  C16H16N2O2        Molecular Weight: 268.31
    IUPAC Name:  tert-butyl 9H-pyrido[3,4-b]indole-3-carboxylate
    SMILES:  CC(C)(C)OC(=O)C1=NC=C2C(=C1)C3=CC=CC=C3N2
    InChIKey: FVFFDKKTXYVCCW-UHFFFAOYSA-N
    InChI:  InChI=1S/C16H16N2O2/c1-16(2,3)20-15(19)13-8-11-10-6-4-5-7-12(10)18-14(11)9-17-13/h4-9,18H,1-3H3
  8. Abecarnil
    Cas Number: 111841-85-1        Compound CID:  65914
    Formula:  C24H24N2O4        Molecular Weight: 404.5
    IUPAC Name:  propan-2-yl 4-(methoxymethyl)-6-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylate
    SMILES:  CC(C)OC(=O)C1=NC=C2C(=C1COC)C3=C(N2)C=CC(=C3)OCC4=CC=CC=C4
    InChIKey: RLFKILXOLJVUNF-UHFFFAOYSA-N
    InChI:  InChI=1S/C24H24N2O4/c1-15(2)30-24(27)23-19(14-28-3)22-18-11-17(29-13-16-7-5-4-6-8-16)9-10-20(18)26-21(22)12-25-23/h4-12,15,26H,13-14H2,1-3H3
  9. 9H-Pyrido[3,4-b]indole-3-carboxylic acid
      Grade & Purity: 
    • ≥98%
    Cas Number: 74214-63-4        Compound CID:  173262
    Formula:  C12H8N2O2        Molecular Weight: 212.2
    IUPAC Name:  9H-pyrido[3,4-b]indole-3-carboxylic acid
    SMILES:  C1=CC=C2C(=C1)C3=CC(=NC=C3N2)C(=O)O
    InChIKey: ARLVFKCLBYUINL-UHFFFAOYSA-N
    InChI:  InChI=1S/C12H8N2O2/c15-12(16)10-5-8-7-3-1-2-4-9(7)14-11(8)6-13-10/h1-6,14H,(H,15,16)
  10. 9-(4’-Aminophenyl)-9H-pyrido[3,4-b]indole-d4
      Grade & Purity: 
    • AR
    Cas Number: 1215697-37-2        Compound CID:  46780343
    Formula:  C17H9D4N3        Molecular Weight: 263.33
    IUPAC Name:  2,3,5,6-tetradeuterio-4-pyrido[3,4-b]indol-9-ylaniline
    SMILES:  C1=CC=C2C(=C1)C3=C(N2C4=CC=C(C=C4)N)C=NC=C3
    InChIKey: CKJBUSARXRFUDR-KDWZCNHSSA-N
    InChI:  InChI=1S/C17H13N3/c18-12-5-7-13(8-6-12)20-16-4-2-1-3-14(16)15-9-10-19-11-17(15)20/h1-11H,18H2/i5D,6D,7D,8D
  11. 1,2,3,4-Tetrahydronorharman-1-one
      Grade & Purity: 
    • ≥97%
    Cas Number: 17952-82-8        EC Number: 241-878-7        Compound CID:  87371
    IUPAC Name:  2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one
    SMILES:  C1CNC(=O)C2=C1C3=CC=CC=C3N2
    InChIKey: FZHZQHNKCPJTNQ-UHFFFAOYSA-N
    InChI:  InChI=1S/C11H10N2O/c14-11-10-8(5-6-12-11)7-3-1-2-4-9(7)13-10/h1-4,13H,5-6H2,(H,12,14)
  12. (S)-Methyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
      Grade & Purity: 
    • ≥95%
    Cas Number: 79815-18-2        Compound CID:  12655248
    Formula:  C13H15ClN2O2        Molecular Weight: 266.72
    IUPAC Name:  methyl (3S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate;hydrochloride
    SMILES:  COC(=O)C1CC2=C(CN1)NC3=CC=CC=C23.Cl
    InChIKey: JQYBNWMURCUTIC-MERQFXBCSA-N
    InChI:  InChI=1S/C13H14N2O2.ClH/c1-17-13(16)11-6-9-8-4-2-3-5-10(8)15-12(9)7-14-11;/h2-5,11,14-15H,6-7H2,1H3;1H/t11-;/m0./s1
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