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Cholesterols and derivatives

Description:

Compounds containing a 3-hydroxylated cholestane core.

Ancestors:

Organic compounds ⮕ Lipids and lipid-like molecules ⮕ Steroids and steroid derivatives ⮕ Cholestane steroids ⮕ Cholesterols and derivatives
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Items 1-12 of 74

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  1. Zymosterol
      Grade & Purity: 
    • ≥98%
    Cas Number: 128-33-6        Compound CID:  92746
    Formula:  C27H44O        Molecular Weight: 384.638
    IUPAC Name:  (3S,5S,10S,13R,14R,17R)-10,13-dimethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
    SMILES:  CC(CCC=C(C)C)C1CCC2C1(CCC3=C2CCC4C3(CCC(C4)O)C)C
    InChIKey: CGSJXLIKVBJVRY-XTGBIJOFSA-N
    InChI:  InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h7,19-21,23-24,28H,6,8-17H2,1-5H3/t19-,20+,21show more
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  2. EPICHOLESTEROL
      Grade & Purity: 
    • ≥97%
    Cas Number: 474-77-1
    Formula:  C27H46O        Molecular Weight: 386.6535
    SMILES:  CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C
    InChIKey: HVYWMOMLDIMFJA-VEIPTCAHSA-N
    InChI:  InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21-show more
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  3. 3-Keto Cholesterol
      Grade & Purity: 
    • ≥95%
    Cas Number: 601-54-7        EC Number: 210-004-6        Compound CID:  9908107
    Formula:  C27H44O        Molecular Weight: 384.64
    IUPAC Name:  (8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
    SMILES:  CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(=O)C4)C)C
    InChIKey: GGCLNOIGPMGLDB-GYKMGIIDSA-N
    InChI:  InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,22-25H,6-8,10-17H2,1-5H3/t19-,22+,23show more
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  4. 3β，5α，6β-Trihydroxycholestane
      Grade & Purity: 
    • ≥95%
    Cas Number: 1253-84-5        Compound CID:  91498
    Formula:  C27H48O3        Molecular Weight: 420.67
    IUPAC Name:  (3S,5R,6R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrenshow more
    SMILES:  CC(C)CCCC(C)C1CCC2C1(CCC3C2CC(C4(C3(CCC(C4)O)C)O)O)C
    InChIKey: YMMFNKXZULYSOQ-RUXQDQFYSA-N
    InChI:  InChI=1S/C27H48O3/c1-17(2)7-6-8-18(3)21-9-10-22-20-15-24(29)27(30)16-19(28)11-14-26(27,5)23(20)12-13-25(21,22)4/h17-24,28-30H,6-16H2,1-5H3/t18-,19+,20show more
    Synonyms: Cholestane-3beta,5alpha,6beta-Triol | (3β,5α,6β)-Cholestane-3,5,6-triol | 3β-Hydroxycholestane-5α,6β-diol | 5α,6β-Dih...
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  5. cholesterol-d7
      Grade & Purity: 
    • ≥98%,≥99 atom% D
    Cas Number: 83199-47-7
    Formula:  C27H39D7O        Molecular Weight: 393.70
    IUPAC Name:  (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6,7,7,7-tetradeuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1show more
    SMILES:  CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C
    InChIKey: HVYWMOMLDIMFJA-IFAPJKRJSA-N
    InChI:  InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+show more
    Synonyms: Cholest-5-en-25,26,26,26,27,27,27-d7-3-ol
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  6. 6-Ketocholestanol
      Grade & Purity: 
    • ≥98%
    Cas Number: 1175-06-0        EC Number: 214-640-5        Compound CID:  102008
    Formula:  C27H46O2        Molecular Weight: 402.65
    IUPAC Name:  (3S,5S,8S,9S,10R,13R,14S,17R)-3-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenshow more
    SMILES:  CC(C)CCCC(C)C1CCC2C1(CCC3C2CC(=O)C4C3(CCC(C4)O)C)C
    InChIKey: JQMQKOQOLPGBBE-ZNCJEFCDSA-N
    InChI:  InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h17-24,28H,6-16H2,1-5H3/t18-,19+,20+,21-,show more
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  7. Dm-CHOC-pen
    Cas Number: 942149-56-6        Compound CID:  16126905
    Formula:  C35H48Cl5NO4        Molecular Weight: 724
    IUPAC Name:  [3,5-dichloro-2-methoxy-6-(trichloromethyl)pyridin-4-yl] [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14show more
    SMILES:  CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)OC5=C(C(=NC(=C5Cl)OC)C(Cl)(Cl)Cl)Cl)C)C
    InChIKey: ZJUUIXYKTPSIOH-LEZJFEBPSA-N
    InChI:  InChI=1S/C35H48Cl5NO4/c1-19(2)8-7-9-20(3)24-12-13-25-23-11-10-21-18-22(14-16-33(21,4)26(23)15-17-34(24,25)5)44-32(42)45-29-27(36)30(35(38,39)40)41-31(show more
    Synonyms: Dm-CHOC-pen | AKOS040751622 | UNII-1S83F4T2WE | CHOLEST-5-EN-3-OL (3.BETA.)-, 3-(3,5-DICHLORO-2-METHOXY-6-(TRICHLOROM...
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  8. Cholesterol-13C2
      Grade & Purity: 
    • ≥99%
    Cas Number: 78887-48-6
    Formula:  C27H46O        Molecular Weight: 388.64
    IUPAC Name:  (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
    SMILES:  CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C
    InChIKey: HVYWMOMLDIMFJA-WKKCFSIESA-N
    InChI:  InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+show more
    Synonyms: F90643 | Cholesterol-13C2 | HY-N0322S5 | Cholesterol-3,4-13C2 | Cholesterol-3,4-13C2, S & P tested, 99 atom % 13C | D...
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  9. 5α-cholestan-3β-ol
      Grade & Purity: 
    • ≥95%
    Cas Number: 80-97-7        EC Number: 201-315-8
    Formula:  C27H48O        Molecular Weight: 388.669
    IUPAC Name:  (3S,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthreshow more
    SMILES:  CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C
    InChIKey: QYIXCDOBOSTCEI-QCYZZNICSA-N
    InChI:  InChI=1S/C27H48O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-25,28H,6-17H2,1-5H3/t19-,20+,21+,22+,23-,show more
    Synonyms: 1814DD66-70FE-4610-86FB-FA8455101768 | NSC-18188 | 5a-Dihydrocholesterol | HY-107819 | 3beta-Hydroxy-5alpha-cholestan...
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  10. lithocholylcholine
    IUPAC Name:  [2-hydroxy-6-(3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)heptyl]-trimethylazanium
    SMILES:  OC(C[N+](C)(C)C)CCCC(C1CCC2C1(C)CCC1C2CCC2C1(C)CCC(C2)O)C
    InChIKey: KWEWGNPMETZMTR-UHFFFAOYSA-N
    InChI:  InChI=1S/C29H54NO2/c1-20(8-7-9-23(32)19-30(4,5)6)25-12-13-26-24-11-10-21-18-22(31)14-16-28(21,2)27(24)15-17-29(25,26)3/h20-27,31-32H,7-19H2,1-6H3/q+1
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  11. 7β, 25-dihydroxycholesterol
    Cas Number: 64907-21-7
    IUPAC Name:  (3S,7R,8S,9S,10R,13R,14S,17R)-17-[(2R)-6-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenantshow more
    SMILES:  CC(CCCC(C)(C)O)C1CCC2C1(CCC3C2C(C=C4C3(CCC(C4)O)C)O)C
    InChIKey: BQMSKLCEWBSPPY-CGSQRZAOSA-N
    InChI:  InChI=1S/C27H46O3/c1-17(7-6-12-25(2,3)30)20-8-9-21-24-22(11-14-27(20,21)5)26(4)13-10-19(28)15-18(26)16-23(24)29/h16-17,19-24,28-30H,6-15H2,1-5H3/t17-,show more
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  12. Cholesterol 5α,6α-epoxide
      Grade & Purity: 
    • ≥95%
    Cas Number: 1250-95-9        EC Number: 215-007-6        Compound CID:  227037
    Formula:  C27H46O2        Molecular Weight: 402.65
    IUPAC Name:  (1S,2R,5S,7R,9S,11S,12S,15R,16R)-2,16-dimethyl-15-[(2R)-6-methylheptan-2-yl]-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadecan-5-ol
    SMILES:  CC(C)CCCC(C)C1CCC2C1(CCC3C2CC4C5(C3(CCC(C5)O)C)O4)C
    InChIKey: PRYIJAGAEJZDBO-ZEQHCUNVSA-N
    InChI:  InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-15-24-27(29-24)16-19(28)11-14-26(27,5)23(20)12-13-25(21,22)4/h17-24,28H,6-16H2,1-5H3/t18-,19+,20+,2show more
    Synonyms: 5,6alpha-epoxy-cholesterol | UNII-3UQ9PF5XBD | Cholestan-3.beta.-ol,6.alpha.-epoxy- | NSC 18176 | 5.alpha.-Cholestan-...
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