Structure Database (LMSD)
Common Name
Kurilensoside F
Systematic Name
(25S)-3β-(2-O-methyl-β-D-xylopyranosyloxy)-cholestan-4β,5α,,8,15α,16β,26-hexol
Synonyms
- (25S)-3-O-(2-O-methyl-beta-D-xylopyranosyl)-cholestane-3beta,4beta,5alpha,8,15alpha,16beta,26-heptol
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
SFKLBZDYZMNXCK-FVIGSPGCSA-N
InChi (Click to copy)
InChI=1S/C33H58O11/c1-17(15-34)7-6-8-18(2)22-24(37)25(38)27-30(22,3)11-10-21-31(4)12-9-20(28(39)33(31,41)14-13-32(21,27)40)44-29-26(42-5)23(36)19(35)16-43-29/h17-29,34-41H,6-16H2,1-5H3/t17-,18+,19+,20-,21+,22-,23-,24+,25-,26+,27+,28-,29-,30+,31+,32-,33+/m0/s1
SMILES (Click to copy)
C1[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@]([H])(C)CCC[C@@H](CO)C)[C@@H](O)[C@H](O)[C@@]4([H])[C@]3(O)CC[C@@]2(O)[C@@H](O)[C@@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2OC)C1
References
Reference
Steroidal monoglycosides from the Far Eastern starfish Hippasteria kurilensis and hypothetic pathways of polyhydroxysteroid biosynthesis in starfish.
Steroids, 2009
DOI: 10.1016/j.steroids.2008.11.007
PMID: 19059276
Steroids, 2009
DOI: 10.1016/j.steroids.2008.11.007
PMID: 19059276
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Hippasteria
(#136939)
Asteroidea
(#7588)
Steroidal monoglycosides from the Far Eastern starfish Hippasteria kurilensis and hypothetic pathways of polyhydroxysteroid biosynthesis in starfish.,
Steroids, 2009
Steroids, 2009
Pubmed ID:
19059276
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
44
Rings
5
Aromatic Rings
0
Rotatable Bonds
9
Van der Waals Molecular Volume
614.35
Topological Polar Surface Area
191.60
Hydrogen Bond Donors
8
Hydrogen Bond Acceptors
11
logP
4.13
Molar Refractivity
165.09
Admin
Created at
-
Updated at
8th Mar 2021