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PHL80509

Obacunone

phyproof® Reference Substance

Synonym(s):

Obacunoic acid 3,4-lactone, Tricoccin S3

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About This Item

Empirical Formula (Hill Notation):
C26H30O7
CAS Number:
751-03-1
Molecular Weight:
454.51
MDL number:
MFCD00075888
UNSPSC Code:
41116107
NACRES:
NA.24

grade

primary reference standard

product line

phyproof® Reference Substance

Assay

≥95.0% (HPLC)

form

powder

manufacturer/tradename

PhytoLab

SMILES string

O=C1C=C[C@]2(C)[C@]3([H])[C@@]([C@]([C@H]4C(O[C@H]5C6=COC=C6)=O)(O4)[C@@]5(C)CC3)(C)C(C[C@@]2([H])C(C)(C)O1)=O

InChI

1S/C26H30O7/c1-22(2)16-12-17(27)25(5)15(23(16,3)9-7-18(28)32-22)6-10-24(4)19(14-8-11-30-13-14)31-21(29)20-26(24,25)33-20/h7-9,11,13,15-16,19-20H,6,10,12H2,1-5H3/t15-,16+,19+,20-,23-,24+,25+,26-/m1/s1

InChI key

MAYJEFRPIKEYBL-OASIGRBWSA-N

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General description

This substance is a primary reference substance with assigned absolute purity (considering chromatographic purity, water, residual solvents, inorganic impurities). The exact value can be found on the certificate. Produced by PhytoLab GmbH & Co. KG

Legal Information

phyproof is a registered trademark of PhytoLab GmbH & Co. KG

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
97763844
118154223

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