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Novobiocin sodium salt
SpectraBase Compound ID 9V6rGbDcrO7
InChI InChI=1S/C31H36N2O11.Na/c1-14(2)7-8-16-13-17(9-11-19(16)34)27(37)33-21-22(35)18-10-12-20(15(3)24(18)42-28(21)38)41-29-23(36)25(43-30(32)39)26(40-6)31(4,5)44-29;/h7,9-13,23,25-26,29,34-36H,8H2,1-6H3,(H2,32,39)(H,33,37);/q;+1/p-1/t23-,25+,26-,29-;/m1./s1
InChIKey WWPRGAYLRGSOSU-RNROJPEYSA-M
Mol Weight 634.6 g/mol
Molecular Formula C31H35N2NaO11
Exact Mass 634.213854 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID EmEuOPFHfai
Name Novobiocin sodium salt
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number J60928
Lot Number N12A034
CAS Registry Number 1476-53-5
Color Properties White to Pale yellow
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Formula C31H35N2NaO11
InChI InChI=1S/C31H36N2O11.Na/c1-14(2)7-8-16-13-17(9-11-19(16)34)27(37)33-21-22(35)18-10-12-20(15(3)24(18)42-28(21)38)41-29-23(36)25(43-30(32)39)26(40-6)31(4,5)44-29;/h7,9-13,23,25-26,29,34-36H,8H2,1-6H3,(H2,32,39)(H,33,37);/q;+1/p-1/t23-,25+,26-,29-;/m1./s1
InChIKey WWPRGAYLRGSOSU-RNROJPEYSA-M
Instrument Name Bruker Tensor 27 FT-IR
Physical State Solid
Sample Type Organic
Source of Spectrum Bio-Rad Laboratories, Inc.
Synonyms 4-[[7-[(2R,3S,4S,5R)-4-Carbamoyloxy-3-hydroxy-5-methoxy-6,6-dimethyloxan-2-yl]oxy-4-hydroxy-8-methyl-2-oxochromen-3-yl]carbamoyl]-2-(3-methylbut-2-enyl)phenolate sodium: Albamycin
Technique ATR-Neat (DuraSamplIR II)