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655759

Sigma-Aldrich

Malonyl-13C3 coenzyme A lithium salt

99 atom % 13C, 95% (CP)

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About This Item

Empirical Formula (Hill Notation):
13C3C21H38N7O19P3S · xLi+
Molecular Weight:
856.56 (free acid basis)
UNSPSC Code:
12352005
PubChem Substance ID:
329760084
NACRES:
NA.12

isotopic purity

99 atom % 13C

Quality Level

200

Assay

95% (CP)

form

solid

mass shift

M+3

storage temp.

−20°C

SMILES string

[Li+].CC(C)(CO[P@@](O)(=O)OP(O)(=O)CO[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)n2cnc3c(N)ncnc23)[C@@H](O)C(=O)NCCC(=O)NCCS[13C](=O)[13CH2][13C]([O-])=O

InChI

1S/C24H38N7O19P3S.Li/c1-24(2,18(37)21(38)27-4-3-12(32)26-5-6-54-14(35)7-13(33)34)8-47-53(44,45)50-51(39,40)11-46-23-17(49-52(41,42)43)16(36)22(48-23)31-10-30-15-19(25)28-9-29-20(15)31;/h9-10,16-18,22-23,36-37H,3-8,11H2,1-2H3,(H,26,32)(H,27,38)(H,33,34)(H,39,40)(H,44,45)(H2,25,28,29)(H2,41,42,43);/q;+1/p-1/t16-,17+,18+,22-,23+;/m1./s1/i7+1,13+1,14+1;

InChI key

XZBFXZRVMJPNCZ-VLZOZIQLSA-M

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Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

Other Notes

Molecular weight and empirical formula based on free acid.

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

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Certificates of Analysis (COA)

Lot/Batch Number
MBBC8695
MBBC3821
MBBB8444V
TA1005V
IY2173

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Fernando Martínez-Montañés et al.
Cell reports, 32(6), 108024-108024 (2020-08-14)
The ability to remodel lipid metabolism under changing conditions is pivotal for cellular functionality and homeostasis. Here, we characterize the regulatory landscape of phosphorylation-based signaling events across the life cycle of Saccharomyces cerevisiae and determine its impact on the regulation

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Sigma-Aldrich.com presents an article concerning MRI/MRS and the use of isotopes in hyperpolarization.

Dynamic Nuclear Polarization

Dynamic Nuclear Polarization (DNP) is a phenomenon by which high spin polarization, typically derived from a bath of free radical electrons, is transferred to a nuclear spin bath, enhancing the difference between the nuclear energy levels and thereby producing dramatically enhanced NMR signals for detection.

Global Trade Item Number

SKUGTIN
655759-25MG4061833238448
655759-10MG4061833238431

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