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(3aR,4R,5R,7S,8S,9R,9aS,12R)-8-hydroxy-4,7,9,12-tetramethyl-3-oxo-7-vinyldecahydro-4,9a-propanocyclopenta[8]annulen-5-yl 2-(((1R,3s,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl)thio)acetate

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Formula: C30H47NO4S
CAS: 224452-66-8

Identification

Structural Formula
(3aR,4R,5R,7S,8S,9R,9aS,12R)-8-hydroxy-4,7,9,12-tetramethyl-3-oxo-7-vinyldecahydro-4,9a-propanocyclopenta[8]annulen-5-yl 2-(((1R,3s,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl)thio)acetate
CAS:
224452-66-8
EINECS:
Molecular Formula:
C30H47NO4S
MDL:
MFCD11045316
Synonym:
acetic acid, 2-[[(3-exo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl]thio]-, (3as,4r,5s,6s,8r,9r,9ar,10r)-6-ethenyldecahydro-5-hydroxy-4,6,9,10-tetramethyl-1-oxo-3a,9-propano-3ah-cyclopentacycloocten-8-yl ester ; retapamulin, >=98% ; (3as,4r,5s,6s,8r,9r,9ar,10r)-2-(exo-8-methyl-8-azabicyclo[3.2.1]octan-3-ylsulfanyl)acetic acid 5-hydroxy-4,6,9,10-tetramethyl-1-oxo-6-vinylperhydro-3a,9-propanocyclopentacycloocten-8-yl ester ; rebapamulin ; sb-275833 ; retapamulin ; tetapamulin ; retapamulin api ; retapamulin (sb-275833) ; (1s,2r,3s,4s,6r,7r,8r,14r)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxotricyclo[5.4.3.0^{1,8}]tetradecan-6-yl 2-{[(1r,3s,5s)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]sulfanyl}acetate




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(3aS,4R,5S,6S,8R,9R,9aR,10R)-2-(exo-8-methyl-8-azabicyclo[3.2.1]octan-3-ylsulfanyl)acetic acid 5-hydroxy-4,6,9,10-tetramethyl-1-oxo-6-vinylperhydro-3a,9-propanocyclopentacycloocten-8-yl ester
3B (Wuhan) Scientific Corporation
3157575472725
(3aR,4R,5R,7S,8S,9R,9aS,12R)-8-hydroxy-4,7,9,12-tetramethyl-5-((3-(((3-exo)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl)thio)prop-1-en-2-yl)oxy)-7-vinyloctahydro-4,9a-propanocyclopenta[8]annulen-3(3ah)-one
BLD Pharmatech Ltd
BP108000324000

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Properties for (3aR,4R,5R,7S,8S,9R,9aS,12R)-8-hydroxy-4,7,9,12-tetramethyl-3-oxo-7-vinyldecahydro-4,9a-propanocyclopenta[8]annulen-5-yl 2-(((1R,3s,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl)thio)acetate

Molecular Weight:
517.77 g·mol−1
Density:
~1.2 g/cm3 (Predicted)
Boiling point:
~594.9 °C at 760 mmHg (Predicted)
Solubility:
Soluble in ethanol (104 mg/ml at 25 °C), methanol, DMF, DMSO (104 mg/ml at 25 °C), and water (moderate).
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Hazard Statements

GHS07

GHS03
Harmful
  • Acute toxicity (oral, dermal, inhalation), category 4
  • Skin irritation, categories 2, 3
  • Eye irritation, category 2A
  • Skin sensitization, category 1
  • Specific target organ toxicity following single exposure, category 3
    - Respiratory tract irritation
    - Narcotic effects
  • Not used
  • with the "skull and crossbones" pictogram
  • for skin or eye irritation if:
  • the "corrosion" pictogram also appears
  • the "health hazard" pictogram is used to indicate respiratory sensitization

Safety & Transport Information

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Alternative Distributors of [(3aR,4R,5R,7S,8S,9R,9aS,12R)-8-hydroxy-4,7,9,12-tetramethyl-3-oxo-7-vinyldecahydro-4,9a-propanocyclopenta[8]annulen-5-yl 2-(((1R,3s,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl)thio)acetate]

Producers or manufacturers change the product range from time to time. The following companies
have appeared as suppliers in the past / currently not verified

TCS INDUSTRY LTD. | Jinan Great Chemical Co., Ltd. | Xiang Ding Chemical International Co., Ltd | Evershine Chemical Co.,Ltd. | ZhiYu Biotechnology Co., Ltd. | Shanghai Yongyi Biotechnology Co., Ltd. | Shanghai Kairen Industrial Co.,Ltd. | Suzhou Rovathin Pharmatech Co., Ltd | Sanowart Group Co., Ltd. | Anix-Chem Limited | Hangzhou Pharma & Chem Co. Ltd. | Apichem Chemical Technology Co., Ltd. | Shanghai Boyle Chemical Co., Ltd. | Shanghai Eliv Pharmaceutical Co., Ltd. | East Chemical Industry Co., Ltd. | Zhejiang Kaili Industrial Co., Ltd. | Discovery Fine Chemicals Limited | Changzhou Weijia Chemical Co.,Ltd. -WJCHEM- | BOC Sciences | Jinan Haohua Industry Co., Ltd. | Lead Biotech (Hangzhou) Co., Ltd. | Shanxi Jinjin Chemical Co., Ltd. | Beijing Mediking Biopharm Co., Ltd. | Xiamen Hisunny Chemical Co., Ltd. | Sino Rarechem Labs Co. Ltd. | Clearsynth Canada INC. | Tianjin Liankuan Fine Chemicals Co., Ltd.

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