Cimiside B

Inquiry

For Research Use Only.

Category

Terpenes

Cat.No.

NP6345

CAS

152685-91-1

Product Name

Cimiside B

Structure

Product Details

Description

Cimiside B is a natural triterpenoid isolated from the root of Saposhnikovia divaricata (Turcz.) Schischk.

Synonyms

cimiside B;β-D-Xylopyranoside, (3β,15α,16α,23R,24S)-16,23:16,24-diepoxy-15,25-dihydroxy-9,19-cyclolanostan-3-yl 3-O-β-D-xylopyranosyl-

IUPAC Name

(2S,3R,4S,5R)-2-[(2S,3R,4S,5R)-3,5-dihydroxy-2-[[(1S,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]oxan-4-yl]oxyoxane-3,4,5-triol

Molecular Weight

752.9

Molecular Formula

C40H64O13

Canonical SMILES

CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)OC9C(C(C(CO9)O)O)O)O)C)O2)C(C)(C)O

InChI

InChI=1S/C40H64O13/c1-18-14-21-30(35(4,5)47)53-40(52-21)29(18)36(6)12-13-39-17-38(39)11-10-24(34(2,3)22(38)8-9-23(39)37(36,7)33(40)46)50-32-27(45)28(20(42)16-49-32)51-31-26(44)25(43)19(41)15-48-31/h18-33,41-47H,8-17H2,1-7H3/t18-,19-,20-,21-,22+,23+,24+,25+,26-,27-,28+,29-,30+,31+,32+,33-,36-,37-,38-,39+,40+/m1/s1

InChIKey

FQXVWSGUAKXSLO-CKLOPMIDSA-N

Purity

>97%

Density

1.39±0.1 g/cm3(Predicted)

Appearance

Powder

pKa

12.82±0.70(Predicted)

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