(1R)-1,5-Dihydroxy Empagliflozin D4

ISO 17034:
Catalog Number : CS-O-12059
CAS Number : 1620758-34-0(Unlabeled)
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Product Information

Product Name : "(1R)-1,5-Dihydroxy Empagliflozin D4"
Category : Stable Isotopes
Therapeutic : Anti-Diabetic

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Canonical SMILES : C1COCC1OC2=CC=C(C=C2)CC3=C(C=CC(=C3)C(C(C(C(C(CO)O)O)O)O)O)Cl
Isomeric SMILES : C1COC[C@H]1OC2=CC=C(C=C2)CC3=C(C=CC(=C3)[C@H]([C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)O)Cl
InChI : InChI=1S/C23H29ClO8/c24-18-6-3-14(20(27)22(29)23(30)21(28)19(26)11-25)10-15(18)9-13-1-4-16(5-2-13)32-17-7-8-31-12-17/h1-6,10,17,19-23,25-30H,7-9,11-12H2/t17-,19+,20+,21+,22-,23-/m0/s1
InchIKey : RKDDAJYLEWTGMU-PNZPLEPNSA-N
IUPAC Name : (1R,2S,3R,4R,5R)-1-[4-chloro-3-[[4-[(3S)-oxolan-3-yl]oxyphenyl]methyl]phenyl]hexane-1,2,3,4,5,6-hexol
Exact Mass : 468.1550956