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7-O-palmitoyl okadaic acid

Product Code

CIF-CRM-02-DTX3A

Product Format

Single Solution

Matrix

Methanol

Molecular Formula

C60 H97 O14 . Na

Molecular Weight

1065.39

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Pack Size:

0.5 mL

Stock expected

Estimated dispatch

Not currently in stock but good availability. Estimated dispatch in 5-10 days.

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Documentation

Certificate of Analysis

17001_REV3(CIF-CRM-02-DTX3A)

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Product Information

Analyte Name

7-O-palmitoyl okadaic acid

Molecular Formula

C60 H97 O14 . Na

Molecular Weight

1065.39

Concentration

7.97 µg/g

Accurate Mass

1064.6776

SMILES

[Na+].CCCCCCCCCCCCCCCC(=O)O[C@@H]1CC[C@@H](C[C@@](C)(O)C(=O)[O-])O[C@]12O[C@@H](CC(=C2)C)[C@H](C)\C=C\[C@H]3CC[C@@]4(CCC5O[C@H]([C@@H](O)C[C@H](C)C6O[C@@]7(CCCCO7)CC[C@H]6C)C(=C)[C@@H](O)[C@@H]5O4)O3

InChI

+1/p-1/b25-24+, InChI=1S/C60H98O14.Na/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-23-51(62)69-50-27-26-46(39-57(7,66)56(64)65)71-60(50)38-40(2)36-49(72-60)41(3)24-25-45-29-33-59(70-45)34-30-48-55(74-59)52(63)44(6)54(68-48)47(61)37-43(5)53-42(4)28-32-58(73-53)31-21-22-35-67-58, /m1./s1, /t41-,42-,43+,45+,46+,47+,48?,49+,50-,52-,53?,54+,55-,57-,58+,59-,60-, /q, /h24-25,38,41-43,45-50,52-55,61,63,66H,6,8-23,26-37,39H2,1-5,7H3,(H,64,65)

IUPAC

sodium;(2R)-3-[(2S,6R,8S,11R)-2-[(E,1R)-3-[(2S,2'R,4R,4aS,6R)-4-hydroxy-2-[(1S,3S)-1-hydroxy-3-[(3R,6S)-3-methyl-1,7-dioxaspiro[5.5]undecan-2-yl]butyl]-3-methylene-spiro[4a,7,8,8a-tetrahydro-4H-pyrano[3,2-b]pyran-6,5'-tetrahydrofuran]-2'-yl]-1-methyl-allyl]-11-hexadecanoyloxy-4-methyl-1,7-dioxaspiro[5.5]undec-4-en-8-yl]-2-hydroxy-2-methyl-propanoate

Storage Temperature

-80°C

Shipping Temperature

Dry ice

Country of Origin

SPAIN

Product Format

Single Solution

Matrix

Methanol

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