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Dibenzylbutane lignans
Description:
Lignan compounds containing a 2,3-dibenzylbutane moiety.
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PregomisinCas Number: 66280-26-0 Compound CID: 181796IUPAC Name: 5-[(2S,3R)-4-(3-hydroxy-4,5-dimethoxyphenyl)-2,3-dimethylbutyl]-2,3-dimethoxyphenolSMILES: CC(CC1=CC(=C(C(=C1)OC)OC)O)C(C)CC2=CC(=C(C(=C2)OC)OC)OInChIKey: RLRKIWSBYUZHIJ-OKILXGFUSA-NInChI: InChI=1S/C22H30O6/c1-13(7-15-9-17(23)21(27-5)19(11-15)25-3)14(2)8-16-10-18(24)22(28-6)20(12-16)26-4/h9-14,23-24H,7-8H2,1-6H3/t13-,14+
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ENTERODIOLIUPAC Name: (2R,3R)-2,3-bis[(3-hydroxyphenyl)methyl]butane-1,4-diolSMILES: C1=CC(=CC(=C1)O)CC(CO)C(CC2=CC(=CC=C2)O)COInChIKey: DWONJCNDULPHLV-HOTGVXAUSA-NInChI: InChI=1S/C18H22O4/c19-11-15(7-13-3-1-5-17(21)9-13)16(12-20)8-14-4-2-6-18(22)10-14/h1-6,9-10,15-16,19-22H,7-8,11-12H2/t15-,16-/m0/s1
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4,4'-(2,3-Dimethylbutane-1,4-diyl)bis(1,2-dimethoxybenzene)Cas Number: 5701-82-6 Compound CID: 97616IUPAC Name: 4-[4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-1,2-dimethoxybenzeneSMILES: CC(CC1=CC(=C(C=C1)OC)OC)C(C)CC2=CC(=C(C=C2)OC)OCInChIKey: ORQFDHFZSMXRLM-UHFFFAOYSA-NInChI: InChI=1S/C22H30O4/c1-15(11-17-7-9-19(23-3)21(13-17)25-5)16(2)12-18-8-10-20(24-4)22(14-18)26-6/h7-10,13-16H,11-12H2,1-6H3
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DihydrocubebinCas Number: 24563-03-9 Compound CID: 193042Formula: C20H22O6 Molecular Weight: 358.4IUPAC Name: (2R,3R)-2,3-bis(1,3-benzodioxol-5-ylmethyl)butane-1,4-diolSMILES: C1OC2=C(O1)C=C(C=C2)CC(CO)C(CC3=CC4=C(C=C3)OCO4)COInChIKey: JKCVMTYNARDGET-HOTGVXAUSA-NInChI: InChI=1S/C20H22O6/c21-9-15(5-13-1-3-17-19(7-13)25-11-23-17)16(10-22)6-14-2-4-18-20(8-14)26-12-24-18/h1-4,7-8,15-16,21-22H,5-6,9-12H2/t15-,16-/m0/s1Synonyms: Dihydrocubebin | (-)-Dihydrocubebin | (2R,3R)-2,3-bis(1,3-benzodioxol-5-ylmethyl)butane-1,4-diol | CHEBI:543841 | 1,4...
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meso-dihydroguaiaretic acidCas Number: 66322-34-7 Compound CID: 476856IUPAC Name: 4-[(2S,3R)-4-(4-hydroxy-3-methoxyphenyl)-2,3-dimethylbutyl]-2-methoxyphenolSMILES: CC(CC1=CC(=C(C=C1)O)OC)C(C)CC2=CC(=C(C=C2)O)OCInChIKey: ADFOLUXMYYCTRR-OKILXGFUSA-NInChI: InChI=1S/C20H26O4/c1-13(9-15-5-7-17(21)19(11-15)23-3)14(2)10-16-6-8-18(22)20(12-16)24-4/h5-8,11-14,21-22H,9-10H2,1-4H3/t13-,14+
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Schineolignin BCas Number: 1352185-26-2 Compound CID: 49871581IUPAC Name: 5-[4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-2,3-dimethoxyphenolSMILES: CC(CC1=CC(=C(C=C1)OC)OC)C(C)CC2=CC(=C(C(=C2)OC)OC)OInChIKey: ITXTZJSELNILSN-UHFFFAOYSA-NInChI: InChI=1S/C22H30O5/c1-14(9-16-7-8-19(24-3)20(12-16)25-4)15(2)10-17-11-18(23)22(27-6)21(13-17)26-5/h7-8,11-15,23H,9-10H2,1-6H3
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MasoprocolCas Number: 27686-84-6 EC Number: 248-606-6Formula: C18H22O4 Molecular Weight: 302.36IUPAC Name: 4-[(2S,3R)-4-(3,4-dihydroxyphenyl)-2,3-dimethylbutyl]benzene-1,2-diolSMILES: CC(CC1=CC(=C(C=C1)O)O)C(C)CC2=CC(=C(C=C2)O)OInChIKey: HCZKYJDFEPMADG-TXEJJXNPSA-NInChI: InChI=1S/C18H22O4/c1-11(7-13-3-5-15(19)17(21)9-13)12(2)8-14-4-6-16(20)18(22)10-14/h3-6,9-12,19-22H,7-8H2,1-2H3/t11-,12+Synonyms: meso-Nordihydroguaiaretic acid | meso-NDGA
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TerameprocolCas Number: 24150-24-1 Compound CID: 476861Formula: C22H30O4 Molecular Weight: 358.47IUPAC Name: 4-[(2S,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-1,2-dimethoxybenzeneSMILES: CC(CC1=CC(=C(C=C1)OC)OC)C(C)CC2=CC(=C(C=C2)OC)OCInChIKey: ORQFDHFZSMXRLM-IYBDPMFKSA-NInChI: InChI=1S/C22H30O4/c1-15(11-17-7-9-19(23-3)21(13-17)25-5)16(2)12-18-8-10-20(24-4)22(14-18)26-6/h7-10,13-16H,11-12H2,1-6H3/t15-,16+Synonyms: D09014 | UNII-53YET703F2 | Tmndga | DB12226 | 1,4-BIS(3,4-DIMETHOXYPHENYL)-2,3-DIMETHYL-, MESO- | 4-[(2S,3R)-4-(3,4-d...
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Nordihydroguaiaretic AcidCas Number: 500-38-9Formula: C18H22O4 Molecular Weight: 302.37IUPAC Name: 4-[4-(3,4-dihydroxyphenyl)-2,3-dimethylbutyl]benzene-1,2-diolSMILES: CC(CC1=CC(=C(C=C1)O)O)C(C)CC2=CC(=C(C=C2)O)OInChIKey: HCZKYJDFEPMADG-UHFFFAOYSA-NInChI: InChI=1S/C18H22O4/c1-11(7-13-3-5-15(19)17(21)9-13)12(2)8-14-4-6-16(20)18(22)10-14/h3-6,9-12,19-22H,7-8H2,1-2H3Synonyms: NORDIHYDROGUAIARETIC ACID|500-38-9|NDGA|Dihydronorguaiaretic acid|Actinex|4-[4-(3,4-dihydroxyphenyl)-2,3-dimethylbuty...
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MacelignanCas Number: 107534-93-0Formula: C20H24O4 Molecular Weight: 328.4IUPAC Name: 4-[(2S,3R)-4-(1,3-benzodioxol-5-yl)-2,3-dimethylbutyl]-2-methoxyphenolSMILES: CC(CC1=CC2=C(C=C1)OCO2)C(C)CC3=CC(=C(C=C3)O)OCInChIKey: QDDILOVMGWUNGD-UONOGXRCSA-NInChI: InChI=1S/C20H24O4/c1-13(8-15-4-6-17(21)19(10-15)22-3)14(2)9-16-5-7-18-20(11-16)24-12-23-18/h4-7,10-11,13-14,21H,8-9,12H2,1-3H3/t13-,14+/m0/s1Synonyms: (+)-Anwulignan;Anwuligan | AKOS037645016 | (+)-Anwulignan | 4-((2S,3R)-4-(benzo[d][1,3]dioxol-5-yl)-2,3-dimethylbutyl...
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SecoisolariciresinolFormula: C20H26O6 Molecular Weight: 362.42IUPAC Name: (2R,3R)-2,3-bis[(4-hydroxy-3-methoxyphenyl)methyl]butane-1,4-diolSMILES: COC1=C(C=CC(=C1)CC(CO)C(CC2=CC(=C(C=C2)O)OC)CO)OInChIKey: PUETUDUXMCLALY-HOTGVXAUSA-NInChI: InChI=1S/C20H26O6/c1-25-19-9-13(3-5-17(19)23)7-15(11-21)16(12-22)8-14-4-6-18(24)20(10-14)26-2/h3-6,9-10,15-16,21-24H,7-8,11-12H2,1-2H3/t15-,16-/m0/s1Synonyms: Secoisolariciresinol | CS-0032316 | C18167 | HMS2052G03 | MLS001424213 | CCG-101074 | HY-N6071 | Q-100372 | (2R*,3R*)...
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Nordihydroguaiaretic AcidCas Number: 500-38-9Formula: C18H22O4 Molecular Weight: 302.37IUPAC Name: 4-[4-(3,4-dihydroxyphenyl)-2,3-dimethylbutyl]benzene-1,2-diolSMILES: CC(CC1=CC(=C(C=C1)O)O)C(C)CC2=CC(=C(C=C2)O)OInChIKey: HCZKYJDFEPMADG-UHFFFAOYSA-NInChI: InChI=1S/C18H22O4/c1-11(7-13-3-5-15(19)17(21)9-13)12(2)8-14-4-6-16(20)18(22)10-14/h3-6,9-12,19-22H,7-8H2,1-2H3Synonyms: NDGA | AC-24202 | HMS503G19 | Z2065671207 | 1, 4,4'-(2,3-dimethyl-1,4-butanediyl)bis- | KBio2_004917 | KBio3_002828 |...
