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Phenanthrenes and derivatives

Description:

Polycyclic compounds containing a phenanthrene moiety, which is a tricyclic aromatic compound with three non-linearly fused benzene.
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  1. Lusianthridin
      Grade & Purity: 
    • ≥98%
    Cas Number: 87530-30-1        Compound CID:  442702
    Formula:  C15H14O3        Molecular Weight: 242.27
    IUPAC Name:  7-methoxy-9,10-dihydrophenanthrene-2,5-diol
    SMILES:  COC1=CC2=C(C3=C(CC2)C=C(C=C3)O)C(=C1)O
    InChIKey: RDKDIPDDUFMMMT-UHFFFAOYSA-N
    InChI:  InChI=1S/C15H14O3/c1-18-12-7-10-3-2-9-6-11(16)4-5-13(9)15(10)14(17)8-12/h4-8,16-17H,2-3H2,1H3
    Synonyms: DTXSID50331917 | BDBM246496 | 2,5-Dihydroxy-7-methoxy-9,10-dihydrophenanthrene (14) | CHEBI:28678 | FS-7984 | 4,7-Dih...
  2. Paliogen® Red Violet K 5411
      Grade & Purity: 
    • Strength 95% -105%
    Cas Number: 81-33-4        EC Number: 201-344-6
    Formula:  C24H10N2O4        Molecular Weight: 390.35
    IUPAC Name:  7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(23),2,4,9,11,13,15,20(24),21,25-decaene-6,8,17,19-tetrone
    SMILES:  C1=CC2=C3C(=CC=C4C3=C1C5=C6C4=CC=C7C6=C(C=C5)C(=O)NC7=O)C(=O)NC2=O
    InChIKey: KJOLVZJFMDVPGB-UHFFFAOYSA-N
    InChI:  InChI=1S/C24H10N2O4/c27-21-13-5-1-9-10-2-6-15-20-16(24(30)26-23(15)29)8-4-12(18(10)20)11-3-7-14(22(28)25-21)19(13)17(9)11/h1-8H,(H,25,27,28)(H,26,29,3show more
    Synonyms: 81-33-4|3,4,9,10-Perylenetetracarboxylic Diimide|Perylimid|perylenediimide|3,4,9,10-Perylenetetracarboxylic acid diim...
  3. naloxegol
    Cas Number: 854601-70-0        Compound CID:  56959087
    IUPAC Name:  (4R,4aS,7S,7aR,12bS)-7-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-prop-2-enyl-1,2,4,5,6,7,7a,13-octahydro-4,12-meshow more
    SMILES:  COCCOCCOCCOCCOCCOCCOCCOC1CCC2(C3CC4=C5C2(C1OC5=C(C=C4)O)CCN3CC=C)O
    InChIKey: XNKCCCKFOQNXKV-ZRSCBOBOSA-N
    InChI:  InChI=1S/C34H53NO11/c1-3-9-35-10-8-33-30-26-4-5-27(36)31(30)46-32(33)28(6-7-34(33,37)29(35)25-26)45-24-23-44-22-21-43-20-19-42-18-17-41-16-15-40-14-13show more
    Synonyms: (1S,5R,13R,14S,17S)-14-(2,5,8,11,14,17,20-heptaoxadocosan-22-yloxy)-4-(prop-2-en-1-yl)-12-oxa-4-azapentacyclo[9.6.1.0...
  4. [³H]naloxone
    IUPAC Name:  (1S,5R,13R,17S)-10,17-dihydroxy-4-(prop-2-en-1-yl)-12-oxa-4-azapentacyclo[9.6.1.0^{1,13}.0^{5,17}.0^{7,18}]octadeca-7(18),8,10-trien-14-one
    SMILES:  C=CCN1CC[C@@]23[C@@]4([C@H]1Cc1c3c(O[C@H]2C(=O)CC4)c(cc1)O)O
    InChIKey: UZHSEJADLWPNLE-GRGSLBFTSA-N
    InChI:  InChI=1S/C19H21NO4/c1-2-8-20-9-7-18-15-11-3-4-12(21)16(15)24-17(18)13(22)5-6-19(18,23)14(20)10-11/h2-4,14,17,21,23H,1,5-10H2/t14-,17+,18+,19-/m1/s1
    Synonyms: Naloxonum (Latin) | Nalossone | NALOXONE [ORANGE BOOK] | NALOXONE [VANDF] | NALOXONE [WHO-DD] | Normorphinone, N-ally...
  5. R,R-THC
    Cas Number: 221368-54-3        Compound CID:  446849
    IUPAC Name:  (5R,11R)-5,11-diethyl-5,6,11,12-tetrahydrochrysene-2,8-diol
    SMILES:  CC[C@@H]1Cc2cc(O)ccc2C2=C1c1ccc(cc1C[C@H]2CC)O
    InChIKey: MASYAWHPJCQLSW-ZIAGYGMSSA-N
    InChI:  InChI=1S/C22H24O2/c1-3-13-9-15-11-17(23)6-8-20(15)22-14(4-2)10-16-12-18(24)5-7-19(16)21(13)22/h5-8,11-14,23-24H,3-4,9-10H2,1-2H3/t13-,14-/m1/s1
    Synonyms: BIDD:ER0043 | JDD6B8E8CW | BRD-K66049797-001-02-6 | HMS3261M08 | (5R, 11R)-5,11-Diethyl-5,6,11,12-tetrahydro-2,8-chry...
  6. β-FNA
    Cas Number: 72782-05-9        Compound CID:  5311018
    IUPAC Name:  methyl (2E)-3-{[(1S,5R,13R,14R,17S)-4-(cyclopropylmethyl)-10,17-dihydroxy-12-oxa-4-azapentacyclo[9.6.1.0^{1,13}.0^{5,17}.0^{7,18}]octadeca-7,9,11(18)-show more
    SMILES:  COC(=O)/C=C/C(=O)N[C@@H]1CC[C@@]2([C@@]34[C@H]1Oc1c4c(C[C@H]2N(CC3)CC2CC2)ccc1O)O
    InChIKey: PQKHESYTSKMWFP-WZJCLRDWSA-N
    InChI:  InChI=1S/C25H30N2O6/c1-32-20(30)7-6-19(29)26-16-8-9-25(31)18-12-15-4-5-17(28)22-21(15)24(25,23(16)33-22)10-11-27(18)13-14-2-3-14/h4-7,14,16,18,23,28,3show more
    Synonyms: DTXSID501316803 | GTPL1631 | methyl (2E)-3-{[(1S,5R,13R,14R,17S)-4-(cyclopropylmethyl)-10,17-dihydroxy-12-oxa-4-azape...
  7. samidorphan
    Cas Number: 852626-89-2        Compound CID:  11667832
    IUPAC Name:  (1R,9R,10S)-17-(cyclopropylmethyl)-3,10-dihydroxy-13-oxo-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene-4-carboxamide
    SMILES:  O=C1CC[C@@]2([C@@]3(C1)CCN([C@@H]2Cc1c3c(O)c(cc1)C(=O)N)CC1CC1)O
    InChIKey: RYIDHLJADOKWFM-MAODMQOUSA-N
    InChI:  InChI=1S/C21H26N2O4/c22-19(26)15-4-3-13-9-16-21(27)6-5-14(24)10-20(21,17(13)18(15)25)7-8-23(16)11-12-1-2-12/h3-4,12,16,25,27H,1-2,5-11H2,(H2,22,26)/t1show more
    Synonyms: DTXSID401030402 | BDBM50165049 | RDC-0313 | 17-(Cyclopropylmethyl)-4,14-dihydroxy-6-oxomorphinan-3-carboxamide | 7W25...
  8. oxycodegol
    Cas Number: 1211231-76-3        Compound CID:  73673720
    IUPAC Name:  (4R,4aS,7S,7aR,12bS)-9-methoxy-7-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-3-methyl-1,2,4,5,6,7,7a,13-octahydro-4,12-methanoshow more
    SMILES:  COCCOCCOCCOCCOCCOCCO[C@H]1CC[C@@]2([C@@]34[C@H]1Oc1c4c(C[C@H]2N(CC3)C)ccc1OC)O
    InChIKey: RQHILGKAOIGUHU-XPLSERNMSA-N
    InChI:  InChI=1S/C31H49NO10/c1-32-9-8-30-27-23-4-5-24(35-3)28(27)42-29(30)25(6-7-31(30,33)26(32)22-23)41-21-20-40-19-18-39-17-16-38-15-14-37-13-12-36-11-10-34show more
    Synonyms: DB14146 | Loxicodegol | D11424 | loxicodegol (deleted INN) | Oxycodegol [USAN] | Oxycodegol [WHO-DD] | Loxicodegol [I...
  9. methylnaltrexone
    Cas Number: 83387-25-1        Compound CID:  5361918
    IUPAC Name:  (4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-3-ium-7-one
    SMILES:  O=C1CC[C@@]2([C@@]34[C@H]1Oc1c4c(C[C@H]2[N+](CC3)(C)CC2CC2)ccc1O)O
    InChIKey: JVLBPIPGETUEET-GAAHOAFPSA-O
    InChI:  InChI=1S/C21H25NO4/c1-22(11-12-2-3-12)9-8-20-17-13-4-5-14(23)18(17)26-19(20)15(24)6-7-21(20,25)16(22)10-13/h4-5,12,16,19,25H,2-3,6-11H2,1H3/p+1/t16-,1show more
    Synonyms: Morphinan-17-ium-6-one, 17-(cyclopropylmethyl)-4,5-epoxy-3,14-dihydroxy-17-methyl-, (5alpha,17R)- | Naltrexone MB | S...
  10. fosdagrocorat
    Cas Number: 1044535-58-1        Compound CID:  24872952
    Formula:  C29H30F3N2O5P        Molecular Weight: 574.5
    IUPAC Name:  [(2R,4aS,10aR)-4a-benzyl-7-[(2-methylpyridin-3-yl)carbamoyl]-2-(trifluoromethyl)-1,3,4,9,10,10a-hexahydrophenanthren-2-yl] dihydrogen phosphate
    SMILES:  O=C(c1ccc2c(c1)CC[C@H]1[C@]2(CC[C@](C1)(OP(=O)(O)O)C(F)(F)F)Cc1ccccc1)Nc1cccnc1C
    InChIKey: BVXLAHSJXXSWFF-KEKPKEOLSA-N
    InChI:  InChI=1S/C29H30F3N2O5P/c1-19-25(8-5-15-33-19)34-26(35)22-10-12-24-21(16-22)9-11-23-18-28(29(30,31)32,39-40(36,37)38)14-13-27(23,24)17-20-6-3-2-4-7-20/show more
    Synonyms: Fosdagrocorat [USAN] | FOSDAGROCORAT [INN] | FOSDAGROCORAT [WHO-DD] | Fosdagrocorat (USAN/INN) | HY-16722 | 2-Phenant...
  11. halofantrine
    Cas Number: 69756-53-2        Compound CID:  37393
    Formula:  C26H30Cl2F3NO        Molecular Weight: 500.44
    IUPAC Name:  3-(dibutylamino)-1-[1,3-dichloro-6-(trifluoromethyl)phenanthren-9-yl]propan-1-ol
    SMILES:  CCCCN(CCCC)CCC(C1=C2C=CC(=CC2=C3C=C(C=C(C3=C1)Cl)Cl)C(F)(F)F)O
    InChIKey: FOHHNHSLJDZUGQ-UHFFFAOYSA-N
    InChI:  InChI=1S/C26H30Cl2F3NO/c1-3-5-10-32(11-6-4-2)12-9-25(33)23-16-22-21(14-18(27)15-24(22)28)20-13-17(26(29,30)31)7-8-19(20)23/h7-8,13-16,25,33H,3-6,9-12Hshow more
    Synonyms: dl-WR 171669 | GTPL10019 | SMR001233418 | Prestwick3_001031 | 1,3-DICHLORO-.ALPHA.-(2-(DIBUTYLAMINO)ETHYL)-6-(TRIFLUO...
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