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SN-38 Glucuronide-d5

Product Specifications

Synonyms

(2S,3S,4S,5R,6S)-6-[[(19S)-10-ethyl-19-hydroxy-14,18-dioxo-19-(1,1,2,2,2-pentadeuterioethyl)-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-7-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid; SN-38 Glucuronide-d5

Hazard Statement

No Data Available

Smiles

[2H]C([2H])([2H])C([2H])([2H])[C@@]1(O)C(=O)OCC2=C1C=C3N(Cc4c(CC)c5cc(O[C@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@H]6O)C(=O)O)ccc5nc34)C2=O

Molecular Formula

C28 D5 H23 N2 O11

Molecular Weight

573.559

InChI

InChI=1S/C28H28N2O11/c1-3-12-13-7-11(40-26-22(33)20(31)21(32)23(41-26)25(35)36)5-6-17(13)29-19-14(12)9-30-18(19)8-16-15(24(30)34)10-39-27(37)28(16,38)4-2/h5-8,20-23,26,31-33,38H,3-4,9-10H2,1-2H3,(H,35,36)/t20-,21-,22+,23-,26+,28-/m0/s1/i2D3,4D2

Additionnal Information

IUPAC name: (2S,3S,4S,5R,6S)-6-[[(19S)-10-ethyl-19-hydroxy-14,18-dioxo-19-(1,1,2,2,2-pentadeuterioethyl)-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-7-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid