Pyrroloindoles

Description:

Compounds containing a pyrroloindole moiety, which is a tricyclic heterocycle which consists of a pyrrole ring fused to an indole. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Indole is a bicyclic compound consisting of a six-membered benzene ring fused to a five-membered nitrogen-containing pyrrole ring.

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  1. Chimonanthine 
    CAS: 5545-89-1 Formula: C22H26N4 Molecular Weight: 346.47
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    Out of Stock Item #: C768292
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    Technical Identifiers
    SMILES
    CN1CCC2(C1NC3=CC=CC=C32)C45CCN(C4NC6=CC=CC=C56)C
    InChIKey
    HOYXPMHLHJOGHD-FNAHDJPLSA-N
    InChI
    1S/C22H26N4/c1-25-13-11-21(15-7-3-5-9-17(15)23-19(21)25)22-12-14-26(2)20(22)24-18-10-6-4-8-16(18)22/h3-10,19-20,23-24H,11-14H2,1-2H3/t19-,20-,21+,22+/show more
    Synonyms
    (-)-Chimonanthine
  2. Eseroline
    CAS: 469-22-7
    Out of Stock Item #: E695592
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    IUPAC Name
    (3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-ol
    SMILES
    CC12CCN(C1N(C3=C2C=C(C=C3)O)C)C
    InChIKey
    HKGWQUVGHPDEBZ-OLZOCXBDSA-N
    InChI
    1S/C13H18N2O/c1-13-6-7-14(2)12(13)15(3)11-5-4-9(16)8-10(11)13/h4-5,8,12,16H,6-7H2,1-3H3/t12-,13+/m1/s1
  3. 5,10-Dihydroindolo[3,2-b]indole
    CAS: 3682-85-7 PubChem CID: 15559033 Formula: C14H10N2 Molecular Weight: 206.24
    Out of Stock Item #: D691378
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    IUPAC Name
    5,10-dihydroindolo[3,2-b]indole
    SMILES
    C1=CC=C2C(=C1)C3=C(N2)C4=CC=CC=C4N3
    InChIKey
    XELZZMRNRUUICC-UHFFFAOYSA-N
    InChI
    1S/C14H10N2/c1-3-7-11-9(5-1)13-14(15-11)10-6-2-4-8-12(10)16-13/h1-8,15-16H
  4. Eptastigmine
    CAS: 101246-68-8 PubChem CID: 65872 Formula: C21H33N3O2 Molecular Weight: 359.5
    Out of Stock Item #: E667934
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    IUPAC Name
    [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] N-heptylcarbamate
    SMILES
    CCCCCCCNC(=O)OC1=CC2=C(C=C1)N(C3C2(CCN3C)C)C
    InChIKey
    RRGMXBQMCUKRLH-CTNGQTDRSA-N
    InChI
    1S/C21H33N3O2/c1-5-6-7-8-9-13-22-20(25)26-16-10-11-18-17(15-16)21(2)12-14-23(3)19(21)24(18)4/h10-11,15,19H,5-9,12-14H2,1-4H3,(H,22,25)/t19-,21+/m1/s1
    Synonyms
    Eptastigmine | Eptastigmine [INN] | N-Demethyl-N-heptylphysostigmine | 6PZZ52D76Q | heptastigmine | Heptylphysostigmi...
  5. (S)-Seco-Duocarmycin SA
    CAS: 152785-82-5 PubChem CID: 11005763 Formula: C25H24ClN3O7 Molecular Weight: 513.93
    Out of Stock Item #: S651266
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    IUPAC Name
    methyl (8S)-8-(chloromethyl)-4-hydroxy-6-(5,6,7-trimethoxy-1H-indole-2-carbonyl)-7,8-dihydro-3H-pyrrolo[3,2-e]indole-2-carboxylate
    SMILES
    COC1=C(C(=C2C(=C1)C=C(N2)C(=O)N3CC(C4=C5C=C(NC5=C(C=C43)O)C(=O)OC)CCl)OC)OC
    InChIKey
    SDJNZXKVYYJDDM-GFCCVEGCSA-N
    InChI
    1S/C25H24ClN3O7/c1-33-18-6-11-5-14(27-20(11)23(35-3)22(18)34-2)24(31)29-10-12(9-26)19-13-7-15(25(32)36-4)28-21(13)17(30)8-16(19)29/h5-8,12,27-28,30H,9show more
  6. Buntanetap
    CAS: 116839-68-0 PubChem CID: 11249342 Formula: C20H23N3O2 Molecular Weight: 337.42
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    Out of Stock Item #: B647602
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    IUPAC Name
    [(3aS,8bR)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] N-phenylcarbamate
    SMILES
    CC12CCN(C1N(C3=C2C=C(C=C3)OC(=O)NC4=CC=CC=C4)C)C
    InChIKey
    PBHFNBQPZCRWQP-AZUAARDMSA-N
    InChI
    1S/C20H23N3O2/c1-20-11-12-22(2)18(20)23(3)17-10-9-15(13-16(17)20)25-19(24)21-14-7-5-4-6-8-14/h4-10,13,18H,11-12H2,1-3H3,(H,21,24)/t18-,20+/m0/s1
    Synonyms
    UNII-Z0O4TJ588O | F82032 | ANVS401 | ANVS-401 | buntanetap [INN] | MS-25127 | Phenserine, (+)- | WHO 12342 | R-Phense...
  7. Chaetocin from Chaetomium minutum
    CAS: 28097-03-2 Formula: C30H28N6O6S4 Molecular Weight: 696.84
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    In Stock Item #: C102377
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    IUPAC Name
    (1S,3R,11R,14S)-14-(hydroxymethyl)-3-[(1S,3R,11R,14S)-14-(hydroxymethyl)-18-methyl-13,17-dioxo-15,16-dithia-10,12,18-triazapentacyclo[12.2.2.01,12.03,show more
    SMILES
    CN1C(=O)C23CC4(C(N2C(=O)C1(SS3)CO)NC5=CC=CC=C54)C67CC89C(=O)N(C(C(=O)N8C6NC1=CC=CC=C71)(SS9)CO)C
    InChIKey
    PZPPOCZWRGNKIR-PNVYSBBASA-N
    InChI
    1S/C30H28N6O6S4/c1-33-21(39)27-11-25(15-7-3-5-9-17(15)31-19(25)35(27)23(41)29(33,13-37)45-43-27)26-12-28-22(40)34(2)30(14-38,46-44-28)24(42)36(28)20(2show more
    Synonyms
    CCG-270384 | Chaetocin | HY-N2019 | (10B,10'B(11H,11'H)-BI-3,11A-EPIDITHIO-11AH-PYRAZINO(1',2':1,5)PYRROLO(2,3-B)INDO...
  8. Chaetocin from Chaetomium minutum
    CAS: 28097-03-2 Formula: C30H28N6O6S4 Molecular Weight: 696.84
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. 10mM in DMSO
    Out of Stock Item #: C422986
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    IUPAC Name
    (1S,3R,11R,14S)-14-(hydroxymethyl)-3-[(1S,3R,11R,14S)-14-(hydroxymethyl)-18-methyl-13,17-dioxo-15,16-dithia-10,12,18-triazapentacyclo[12.2.2.01,12.03,show more
    SMILES
    CN1C(=O)C23CC4(C(N2C(=O)C1(SS3)CO)NC5=CC=CC=C54)C67CC89C(=O)N(C(C(=O)N8C6NC1=CC=CC=C71)(SS9)CO)C
    InChIKey
    PZPPOCZWRGNKIR-PNVYSBBASA-N
    InChI
    1S/C30H28N6O6S4/c1-33-21(39)27-11-25(15-7-3-5-9-17(15)31-19(25)35(27)23(41)29(33,13-37)45-43-27)26-12-28-22(40)34(2)30(14-38,46-44-28)24(42)36(28)20(2show more
    Synonyms
    CCG-270384 | Chaetocin | HY-N2019 | (10B,10'B(11H,11'H)-BI-3,11A-EPIDITHIO-11AH-PYRAZINO(1',2':1,5)PYRROLO(2,3-B)INDO...
  9. Chetomin
    CAS: 1403-36-7 Formula: C31H32N6O6S4 Molecular Weight: 712.87
    Out of Stock Item #: C276197
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    IUPAC Name
    (1S,3S,11R,14S)-14-(hydroxymethyl)-3-[3-[[(1S,4S)-4-(hydroxymethyl)-5,7-dimethyl-6,8-dioxo-2,3-dithia-5,7-diazabicyclo[2.2.2]octan-1-yl]methyl]indol-1show more
    SMILES
    CN1C(=O)C2(N(C(=O)C1(SS2)CC3=CN(C4=CC=CC=C43)C56CC78C(=O)N(C(C(=O)N7C5NC9=CC=CC=C69)(SS8)CO)C)C)CO
    InChIKey
    ZRZWBWPDBOVIGQ-YWZWRZHGSA-N
    InChI
    1S/C31H30N6O6S4/c1-33-25(42)30(15-38)34(2)23(40)28(33,44-46-30)12-17-13-36(21-11-7-4-8-18(17)21)27-14-29-24(41)35(3)31(16-39,47-45-29)26(43)37(29)22(2show more
    Synonyms
    14-(Hydroxymethyl)-3-[3-[[4-(hydroxymethyl)-5,7-dimethyl-6,8-dioxo-2,3-dithia-5,7-diazabicyclo[2.2.2]octan-1-yl]methy...
  10. Physostigmine salicylate
    CAS: 57-64-7 EC Number: 200-343-8 Formula: C15H21N3O2・C7H6O3 Molecular Weight: 413.47
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    Out of Stock Item #: P337839
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    IUPAC Name
    [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] N-methylcarbamate;2-hydroxybenzoic acid
    SMILES
    C[C@@]12CCN([C@@H]1N(C3=C2C=C(C=C3)OC(=O)NC)C)C.C1=CC=C(C(=C1)C(=O)O)O
    InChIKey
    HZOTZTANVBDFOF-PBCQUBLHSA-N
    InChI
    1S/C15H21N3O2.C7H6O3/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2;8-6-4-2-1-3-5(6)7(9)10/h5-6,9,13H,7-8H2,1-4H3,(H,16,19);1-4,8H,(H,9,show more
    Synonyms
    Eserine salicylate
  11. Bizelesin
    CAS: 129655-21-6 PubChem CID: 60794 Formula: C43H36Cl2N8O5 Molecular Weight: 815.7
    Out of Stock Item #: B351163
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    IUPAC Name
    1,3-bis[2-[(8S)-8-(chloromethyl)-4-hydroxy-1-methyl-7,8-dihydro-3H-pyrrolo[3,2-e]indole-6-carbonyl]-1H-indol-5-yl]urea
    SMILES
    CC1=CNC2=C(C=C3C(=C12)C(CN3C(=O)C4=CC5=C(N4)C=CC(=C5)NC(=O)NC6=CC7=C(C=C6)NC(=C7)C(=O)N8CC(C9=C1C(=CNC1=C(C=C98)O)C)CCl)CCl)O
    InChIKey
    FONKWHRXTPJODV-DNQXCXABSA-N
    InChI
    1S/C43H36Cl2N8O5/c1-19-15-46-39-33(54)11-31-37(35(19)39)23(13-44)17-52(31)41(56)29-9-21-7-25(3-5-27(21)50-29)48-43(58)49-26-4-6-28-22(8-26)10-30(51-28show more
    Synonyms
    1,3-bis[2-[(8S)-8-(chloromethyl)-4-hydroxy-1-methyl-7,8-dihydro-3H-pyrrolo[3,2-e]indole-6-carbonyl]-1H-indol-5-yl]ure...
  12. Physostigmine hemisulfate
    CAS: 64-47-1 PubChem CID: 6419928 Formula: C30H44N6O8S Molecular Weight: 648.77
    Out of Stock Item #: P276096
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    IUPAC Name
    [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] N-methylcarbamate;sulfuric acid
    SMILES
    CC12CCN(C1N(C3=C2C=C(C=C3)OC(=O)NC)C)C.CC12CCN(C1N(C3=C2C=C(C=C3)OC(=O)NC)C)C.OS(=O)(=O)O
    InChIKey
    YYBNDIVPHIWTPK-KYJQVDHRSA-N
    InChI
    1S/2C15H21N3O2.H2O4S/c2*1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2;1-5(2,3)4/h2*5-6,9,13H,7-8H2,1-4H3,(H,16,19);(H2,1,2,3,4)/t2*13-,1show more
    Synonyms
    [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl]N-methylcarbamatesulfuricacid
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