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Merck
CN

40820

Chebulinic acid

analytical standard

Synonym(s):

Eutannin, NSC 69862

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About This Item

Empirical Formula (Hill Notation):
C41H32O27
CAS Number:
Molecular Weight:
956.68
MDL number:
UNSPSC Code:
85151701
NACRES:
NA.24
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SMILES string

O1[C@@H]2[C@H](O[C@H]([C@H](OC(=O)c6c7c(c(c(c6)O)O)OC(=O)[C@H]([C@H]7[C@@H](C1=O)CC(=O)O)O)[C@H]2OC(=O)c5cc(c(c(c5)O)O)O)OC(=O)c4cc(c(c(c4)O)O)O)COC(=O)c3cc(c(c(c3)O)O)O

InChI

1S/C41H32O27/c42-15-1-10(2-16(43)26(15)51)35(56)62-9-22-31-33(66-36(57)11-3-17(44)27(52)18(45)4-11)34(41(63-22)68-37(58)12-5-19(46)28(53)20(47)6-12)67-38(59)13-7-21(48)29(54)32-25(13)24(30(55)40(61)65-32)14(8-23(49)50)39(60)64-31/h1-7,14,22,24,30-31,33-34,41-48,51-55H,8-9H2,(H,49,50)/t14-,22+,24-,30-,31+,33-,34+,41-/m0/s1

InChI key

YGVHOSGNOYKRIH-FJPMMHPYSA-N

grade

analytical standard

assay

≥90.0% (HPLC)

shelf life

limited shelf life, expiry date on the label

format

neat

storage temp.

2-8°C

Quality Level

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Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable


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