Reference Materials-Aladdin Scientific

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Retinoic acid
- ≥98%
Cas#: 302-79-4 Compound CID: 444795

Formula: C₂₀H₂₈O₂ Molecular Weight: 300.44

IUPAC Name: (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoic acid

SMILES: CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC(=O)O)C)C

InChIKey: SHGAZHPCJJPHSC-YCNIQYBTSA-N

InChI: InChI=1S/C20H28O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(H,21,22)/b9-6+,12-11+,15-8+,16-14+

Synonyms: (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid | TRETINOIN COMPONENT OF...
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Kaempferol, Inhibitor of CYP2A13
- ≥98%
Cas#: 520-18-3 Compound CID: 5280863

Formula: C₁₅H₁₀O₆ Molecular Weight: 286.24

IUPAC Name: 3,5,7-trihydroxy-2-(4-hydroxyphenyl)chromen-4-one

SMILES: C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O

InChIKey: IYRMWMYZSQPJKC-UHFFFAOYSA-N

InChI: InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H

Synonyms: 5,7,4'-Trihydroxyflavonol | DTXCID30768 | Indigo Yellow | KAEMPFEROL [INCI] | Kampferol | SPBio_003058 | NSC656277 | ...
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Kaempferol
- ≥97%
Cas#: 520-18-3 Compound CID: 5280863

Formula: C₁₅H₁₀O₆ Molecular Weight: 286.24

IUPAC Name: 3,5,7-trihydroxy-2-(4-hydroxyphenyl)chromen-4-one

SMILES: C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O

InChIKey: IYRMWMYZSQPJKC-UHFFFAOYSA-N

InChI: InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H

Synonyms: 5,7,4'-Trihydroxyflavonol | DTXCID30768 | Indigo Yellow | KAEMPFEROL [INCI] | Kampferol | SPBio_003058 | NSC656277 | ...
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Paclitaxel, Agonist of Pregnane X receptor;Agonist of TLR4;Inhibitor of tubulin beta class I
- ≥99%
Cas#: 33069-62-4 Compound CID: 36314

Formula: C₄₇H₅₁NO₁₄ Molecular Weight: 853.91

IUPAC Name: [(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4,12-diacetyloxy-15-[(2R,3S)-3-benzamido-2-hydroxy-3-phenylpropanoyl]oxy-1,9-dihydroxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate

SMILES: CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)O)O)OC(=O)C7=CC=CC=C7)(CO4)OC(=O)C)O)C)OC(=O)C

InChIKey: RCINICONZNJXQF-MZXODVADSA-N

InChI: InChI=1S/C47H51NO14/c1-25-31(60-43(56)36(52)35(28-16-10-7-11-17-28)48-41(54)29-18-12-8-13-19-29)23-47(57)40(61-42(55)30-20-14-9-15-21-30)38-45(6,32(51)22-33-46(38,24-58-33)62-27(3)50)39(53)37(59-26(2)49)34(25)44(47,4)5/h7-21,31-33,35-38,40,51-52,57H,22-24H2,1-6H3,(H,48,54)/t31-,32-,33+,35-,36+,37+,38-,40-,45+,46-,47+/m0/s1

Synonyms: NSC125973 | NSC-125973 | Onxal | ORAXOL COMPONENT PACLITAXEL | Pacliex | (2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-9-(((2R...
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3,4-Benzopyrene
Cas#: 50-32-8 Compound CID: 2336

Formula: C₂₀H₁₂ Molecular Weight: 252.31

IUPAC Name: benzo[a]pyrene

SMILES: C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=CC=C5)C=C3

InChIKey: FMMWHPNWAFZXNH-UHFFFAOYSA-N

InChI: InChI=1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H

Synonyms: 3,4-Benz(a)pyrene | 3,4-Benzopirene | 3,4-Benzpyrene | Benzo(3,4)pyrene, radical ion(1+) | KBioSS_002390 | NCI60_0018...
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3,3',4,4'-Tetrachlorobiphenyl
Cas#: 32598-13-3 Compound CID: 36187

Formula: C₁₂H₆Cl₄ Molecular Weight: 291.99

IUPAC Name: 1,2-dichloro-4-(3,4-dichlorophenyl)benzene

SMILES: C1=CC(=C(C=C1C2=CC(=C(C=C2)Cl)Cl)Cl)Cl

InChIKey: UQMGJOKDKOLIDP-UHFFFAOYSA-N

InChI: InChI=1S/C12H6Cl4/c13-9-3-1-7(5-11(9)15)8-2-4-10(14)12(16)6-8/h1-6H

Synonyms: 3,3',4,4'-Tetrachloro(14C-U)biphenyl | 3,3',4,4'-tetrachlorobinphenyl | PCB 77 | 1,1'-Biphenyl, 3,3',4,4'-tetrachloro...
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3,4-Benzopyrene solution
- 5.0ug/mL in methanol
Cas#: 50-32-8 Compound CID: 2336

Formula: C₂₀H₁₂ Molecular Weight: 252.31

IUPAC Name: benzo[a]pyrene

SMILES: C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=CC=C5)C=C3

InChIKey: FMMWHPNWAFZXNH-UHFFFAOYSA-N

InChI: InChI=1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H

Synonyms: benzo[a]pyrene|50-32-8|3,4-Benzopyrene|benzo[pqr]tetraphene|BENZO(A)PYRENE|3,4-Benzpyrene|benzo[def]chrysene|Benzpyre...
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Benzo[a]pyrene-d12 standard solution
- 2000μg/ml in Toluene
Cas#: 50-32-8 Compound CID: 2336

Formula: C₂₀H₁₂ Molecular Weight: 252.31

IUPAC Name: benzo[a]pyrene

SMILES: C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=CC=C5)C=C3

InChIKey: FMMWHPNWAFZXNH-UHFFFAOYSA-N

InChI: InChI=1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H

Synonyms: benzo[a]pyrene|50-32-8|3,4-Benzopyrene|benzo[pqr]tetraphene|BENZO(A)PYRENE|3,4-Benzpyrene|benzo[def]chrysene|Benzpyre...
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Kaempferol, Inhibitor of CYP2A13
- 10mM in DMSO
Cas#: 520-18-3 Compound CID: 5280863

Formula: C₁₅H₁₀O₆ Molecular Weight: 286.24

IUPAC Name: 3,5,7-trihydroxy-2-(4-hydroxyphenyl)chromen-4-one

SMILES: C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O

InChIKey: IYRMWMYZSQPJKC-UHFFFAOYSA-N

InChI: InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H

Synonyms: kaempferol|520-18-3|Robigenin|Kaempherol|Kempferol|Populnetin|Rhamnolutein|Trifolitin|Swartziol|Pelargidenolon|Rhamno...
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Linolenic acid
- ≥99%
Cas#: 463-40-1 Compound CID: 5280934

Formula: C₁₈H₃₀O₂ Molecular Weight: 278.44

IUPAC Name: (9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid

SMILES: CCC=CCC=CCC=CCCCCCCCC(=O)O

InChIKey: DTOSIQBPPRVQHS-PDBXOOCHSA-N

InChI: InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10H,2,5,8,11-17H2,1H3,(H,19,20)/b4-3-,7-6-,10-9-

Synonyms: cis,cis,cis-9,12,15-Octadecatrienoic acid | (Z,Z,Z)-9,12,15-Octadecatrienoic acid | linolenate | linolenic acid | (9Z...
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Retinoic acid, Retinoic acid receptor agonist
Cas#: 302-79-4 Compound CID: 444795

Formula: C₂₀H₂₈O₂ Molecular Weight: 300.44

IUPAC Name: (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoic acid

SMILES: CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC(=O)O)C)C

InChIKey: SHGAZHPCJJPHSC-YCNIQYBTSA-N

InChI: InChI=1S/C20H28O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(H,21,22)/b9-6+,12-11+,15-8+,16-14+

Synonyms: (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid | TRETINOIN COMPONENT OF...
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Schisandrin A, Agonist of Pregnane X receptor
- 10mM in DMSO
Cas#: 61281-38-7 Compound CID: 155256

Formula: C₂₄H₃₂O₆ Molecular Weight: 416.51

IUPAC Name: (9R,10S)-3,4,5,14,15,16-hexamethoxy-9,10-dimethyltricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaene

SMILES: CC1CC2=CC(=C(C(=C2C3=C(C(=C(C=C3CC1C)OC)OC)OC)OC)OC)OC

InChIKey: JEJFTTRHGBKKEI-OKILXGFUSA-N

InChI: InChI=1S/C24H32O6/c1-13-9-15-11-17(25-3)21(27-5)23(29-7)19(15)20-16(10-14(13)2)12-18(26-4)22(28-6)24(20)30-8/h11-14H,9-10H2,1-8H3/t13-,14+

Synonyms: schisandrin A|Schizandrin A|61281-38-7|Deoxyschisandrin|Deoxyschizandrin|Wuweizisu A|(+)-Deoxyschizandrin|(-)-Deoxysc...
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