Introduction:Basic information about CAS 596-86-1|Ergotaman-3a(2),6a(2),18-trione, 9,10-dihydro-10,12a(2)-dihydroxy-2a(2)-methyl-5a(2)-(p, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Ergotaman-3a(2),6a(2),18-trione, 9,10-dihydro-10,12a(2)-dihydroxy-2a(2)-methyl-5a(2)-(phenylmethyl)-, (5a(2)I+/-,8I+/-,10I(2))- |
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| CAS Number | 596-86-1 | Molecular Weight | 599.7 |
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| Density | / | Boiling Point | / |
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| Molecular Formula | C33H37N5O6 | Melting Point | / |
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| MSDS | / | Flash Point | / |
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Names
| Name | Ergotaman-3a(2),6a(2),18-trione, 9,10-dihydro-10,12a(2)-dihydroxy-2a(2)-methyl-5a(2)-(phenylmethyl)-, (5a(2)I+/-,8I+/-,10I(2))- |
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Chemical & Physical Properties
| Molecular Formula | C33H37N5O6 |
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| Molecular Weight | 599.7 |
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| InChIKey | AXQHJDZSNBUSKE-KCRCCBBKSA-N |
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| SMILES | CN1CC(C(=O)NC2(C)OC3(O)C4CCCN4C(=O)C(Cc4ccccc4)N3C2=O)CC2(O)c3cccc4[nH]cc(c34)CC12 |
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