Introduction：Basic information about CAS 306387-90-6|Cyclopamine-KAAD, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Cyclopamine-KAAD |
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| CAS Number | 306387-90-6 | Molecular Weight | 697.99 |
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| Density | 1.15g/cm3 | Boiling Point | 875.6ºC at 760 mmHg |
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| Molecular Formula | C44H63N3O4 | Melting Point | / |
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| MSDS | / | Flash Point | 483.3ºC |
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Names
| Name | N-[2-[(3'R,7'aR)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,6,6a,6b,7,8,11,11a-decahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]ethyl]-6-(3-phenylpropanoylamino)hexanamide |
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| Synonym | More Synonyms |
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Cyclopamine-KAAD BiologicalActivity
| Description | KAAD-Cyclopamine, a hedgehog signaling inhibitor, is a smoothened antagonist[1]. |
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| Related Catalog | Signaling Pathways >>Stem Cell/Wnt >>SmoResearch Areas >>Cancer |
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| In Vitro | KAAD-Cyclopamine inhibits pathway activation induced by 1 μM purmorphamine with an IC50 of 3 nM, wheras this cyclopamine derivative has an IC50 of 100 nM in Shh-LIGHT2 cells stimulated with 10 μM purmorphamine[1]. |
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| References | [1]. Surajit Sinha, et al. Purmorphamine activates the Hedgehog pathway by targeting Smoothened. Nat Chem Biol. 2006 Jan;2(1):29-30. [2]. Xiaoli Ma, et al. Frequent activation of the hedgehog pathway in advanced gastric adenocarcinomas. Carcinogenesis. 2005 Oct;26(10):1698-705. |
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Chemical & Physical Properties
| Density | 1.15g/cm3 |
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| Boiling Point | 875.6ºC at 760 mmHg |
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| Molecular Formula | C44H63N3O4 |
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| Molecular Weight | 697.99 |
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| Flash Point | 483.3ºC |
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| Exact Mass | 697.48200 |
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| PSA | 101.73000 |
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| LogP | 8.40240 |
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| Index of Refraction | 1.588 |
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| InChIKey | WDHRPWOAMDJICD-BWBMXWGBSA-N |
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| SMILES | CC1=C2CC3C(CC=C4CC(=O)CCC43C)C2CCC12OC1CC(C)CN(CCNC(=O)CCCCCNC(=O)CCc3ccccc3)C1C2C |
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Safety Information
Synonyms
| Cyclopamine-KAAD |
| Shh Signaling Antagonist II |
| 3-Keto-N-aminoethyl-N'-aminocaproyldihydrocinnamoyl Cyclopamine |
| KAAD-Cyclopamine |
