10-(3-Aminopropyl)-8-chloro-10H-phenothiazin-3-yl β-D-glucopyranosiduronic acid
CAS Registry Number®
52247-94-6
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CAS Name
10-(3-Aminopropyl)-8-chloro-10H-phenothiazin-3-yl β-D-glucopyranosiduronic acidMolecular Formula
C21H23ClN2O7SMolecular Mass
482.93Cite this Page
10-(3-Aminopropyl)-8-chloro-10H-phenothiazin-3-yl β-D-glucopyranosiduronic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=52247-94-6 (retrieved ) (CAS RN: 52247-94-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C21H23ClN2O7S/c22-10-2-5-14-13(8-10)24(7-1-6-23)12-4-3-11(9-15(12)32-14)30-21-18(27)16(25)17(26)19(31-21)20(28)29/h2-5,8-9,16-19,21,25-27H,1,6-7,23H2,(H,28,29)/t16-,17-,18+,19-,21+/m0/s1
InChIKey
InChIKey=XWBUNTLAAJOGNQ-ZFORQUDYSA-N
SMILES
C(CCN)N1C=2C(SC=3C1=CC=C(O[C@@H]4O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]4O)C3)=CC=C(Cl)C2
Canonical SMILES
O=C(O)C1OC(OC2=CC=C3C(SC4=CC=C(Cl)C=C4N3CCCN)=C2)C(O)C(O)C1O
Other Names for this Substance
- β-D-Glucopyranosiduronic acid, 10-(3-aminopropyl)-8-chloro-10H-phenothiazin-3-yl
- 10-(3-Aminopropyl)-8-chloro-10H-phenothiazin-3-yl β-D-glucopyranosiduronic acid
- 7-Hydroxydidemethylchlorpromazine glucuronide
Deleted or Replaced CAS Registry Numbers
2518-10-7, 100432-91-5
