21-Episerratriol

Inquiry

For Research Use Only.

Category

Terpenes

Cat.No.

NP6501

CAS

24513-57-3

Product Name

21-Episerratriol

Structure

Product Details

Description

21-Episerratriol is a natural triterpenoid found in the herbs of Lycopodium serratum Thunb.

Synonyms

3-Epilycoclavanol

IUPAC Name

(3S,6R,7S,8S,11R,12S,15S,16R,19R,21R)-7-(hydroxymethyl)-3,7,11,16,20,20-hexamethylpentacyclo[13.8.0.03,12.06,11.016,21]tricos-1(23)-ene-8,19-diol

Molecular Weight

458.7

Molecular Formula

C30H50O3

Canonical SMILES

CC1(C(CCC2(C1CC=C3C2CCC4C(C3)(CCC5C4(CCC(C5(C)CO)O)C)C)C)O)C

InChI

InChI=1S/C30H50O3/c1-26(2)21-9-7-19-17-27(3)14-11-23-29(5,16-13-25(33)30(23,6)18-31)22(27)10-8-20(19)28(21,4)15-12-24(26)32/h7,20-25,31-33H,8-18H2,1-6H3/t20-,21-,22-,23+,24+,25-,27-,28+,29+,30+/m0/s1

InChIKey

VYUNCIDAMBNEFU-CLLDTJQCSA-N

Boiling Point

566.1±50.0 °C(Predicted)

Purity

>95%

Density

1.10±0.1 g/cm3(Predicted)

Appearance

Powder

pKa

14.93±0.70(Predicted)

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