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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 1β-Hydroxy vitamin D2 , CAS No.127516-23-8
Synonyms
(1R,3R,5Z,7E,22E)-9,10-Secoergosta-5,7,10,22-tetraene-1,3-diol | AKOS040744265 | Impurity of Doxercalciferol | HY-76937 | MS-27134 | SCHEMBL9051060 | 1beta-HydroxyVitaminD2 | (1R,3R,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-7a-m
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Why this grade for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships Normal Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Sinónimos
(1R, 3R, 5Z, 7E, 22E)-9, 10-Secoergosta-5, 7, 10, 22-tetraene-1, 3-diol | AKOS040744265 | Impurity of Doxercalciferol | HY-76937 | MS-27134 | SCHEMBL9051060 | 1beta-HydroxyVitaminD2 | (1R, 3R, 5Z)-5-[(2E)-2-[(1R, 3aS, 7aR)-1-[(E, 2R, 5R)-5, 6-dimethylhept-3-en-2-yl]-7a-m
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Sonrisas canónicas CC(C)C(C)C=CC(C)C1CCC2C1(CCCC2=CC=C3CC(CC(C3=C)O)O)C IUPAC Name (1R,3R,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol InChIKey HKXBNHCUPKIYDM-BLKIPSJVSA-N INCHI 1S/C28H44O2/c1-18(2)19(3)9-10-20(4)25-13-14-26-22(8-7-15-28(25,26)6)11-12-23-16-24(29)17-27(30)21(23)5/h9-12,18-20,24-27,29-30H,5,7-8,13-17H2,1-4,6H3/b10-9+,22-11+,23-12-/t19-,20+,24+,25+,26-,27+,28+/m0/s1 Isómeros SMILES C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@H](C3=C)O)O)C PubChem CID 21767860 Peso molecular 412.65
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Lipids and lipid-like molecules Clase Steroids and steroid derivatives Subclass Vitamin D and derivatives Intermediate Tree Nodes Not available Direct Parent Vitamin D and derivatives Alternative Parents Triterpenoids Secondary alcohols Cyclic alcohols and derivatives Hydrocarbon derivatives Molecular Framework Aliphatic homopolycyclic compounds Substituents Triterpenoid - Cyclic alcohol - Secondary alcohol - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aliphatic homopolycyclic compound Descripción This compound belongs to the class of organic compounds known as vitamin d and derivatives. These are compounds containing a secosteroid backbone, usually secoergostane or secocholestane. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Estructura 3D Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Peso molecular 412.600 g/mol XLogP3 6.300 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 5 Exact Mass 412.334 Da Monoisotopic Mass 412.334 Da Topological Polar Surface Area 40.500 Ų Heavy Atom Count 30 Formal Charge 0 Complexity 712.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 7 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 3 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 3 Covalently-Bonded Unit Count 1
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