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Merck
CN

PHL80422

12-Deoxywithastramonolide

phyproof® Reference Substance

Synonym(s):

(5α,6α,7α,22R)-6,7-Epoxy-5,22,27-trihydroxy-1-oxoergosta-2,24-dien-26-oic acid δ-lactone, 27-Hydroxywithanolide B, Baimantuoluoside C aglycone

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About This Item

Empirical Formula (Hill Notation):
C28H38O6
CAS Number:
Molecular Weight:
470.60
UNSPSC Code:
41116107
NACRES:
NA.24
MDL number:
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grade

primary reference standard

product line

phyproof® Reference Substance

assay

≥90.0% (HPLC)

form

solid

manufacturer/tradename

PhytoLab

storage temp.

−20°C

SMILES string

O=C1[C@@]2(C)[C@]([C@@H](O3)[C@@H]3[C@]4([H])[C@]2([H])CC[C@@]5(C)[C@@]4([H])CC[C@@]5([C@H](C)[C@@]6([H])CC(C)=C(CO)C(O6)=O)[H])(O)CC=C1

InChI

1S/C28H38O6/c1-14-12-20(33-25(31)16(14)13-29)15(2)17-7-8-18-22-19(9-11-26(17,18)3)27(4)21(30)6-5-10-28(27,32)24-23(22)34-24/h5-6,15,17-20,22-24,29,32H,7-13H2,1-4H3/t15-,17+,18-,19-,20+,22-,23-,24-,26+,27-,28-/m0/s1

InChI key

AWVMHXZWAKRDGG-MEBIVHGNSA-N

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

Other Notes

This compound is commonly found in plants of the genus: withania

Legal Information

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


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Storage Class

13 - Non Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable



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