Aescine

CAS
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Purity
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CAS
6805-41-0
Size
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Purity
Purity >95%
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Catalog Number

ACM6805410

Product Name

Aescine

Structure

CAS

6805-41-0

Category

Heterocyclic Organic Compound

Synonyms

AESCINE, 6805-41-0

IUPAC Name

6-[[(4S,6aR,6bS,8aR,14bR)-9-acetyloxy-8-hydroxy-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-10-(2-methylbut-2-enoyloxy)-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-

Molecular Weight

1131.26

Molecular Formula

C₅₅H₈₆O₂₄

Canonical SMILES

CC=C(C)C(=O)OC1C(C2(C(CC1(C)C)C3=CCC4C5(CCC(C(C5CCC4(C3(CC2O)C)C)(C)CO)OC6C(C(C(C(O6)C(=O)O)OC7C(C(C(C(O7)CO)O)O)O)O)OC8C(C(C(C(O8)CO)O)O)O)C)CO)OC(=O)C

InChI Key

AXNVHPCVMSNXNP-VJLKZOTMSA-N

Boiling Point

1140.6ºC at 760 mmHg

Flash Point

311.8ºC

Density

1.46 g/cm³

Appearance

white powder

EC Number

229-880-6