Structure Database (LMSD)
Common Name
Asteriidoside L
Systematic Name
3β-(β-D-xylopyranosyloxy)-6β,8β,15α-trihydroxy-campest-22E-en-28-yl sulfate
Synonyms
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
HOPGMEPQEXMAFV-DZHKRNPFSA-N
InChi (Click to copy)
InChI=1S/C33H56O12S/c1-17(2)19(15-44-46(40,41)42)7-6-18(3)21-13-23(34)29-32(21,5)11-9-26-31(4)10-8-20(12-22(31)24(35)14-33(26,29)39)45-30-28(38)27(37)25(36)16-43-30/h6-7,17-30,34-39H,8-16H2,1-5H3,(H,40,41,42)/b7-6+/t18-,19+,20+,21-,22-,23+,24-,25-,26-,27+,28-,29-,30+,31+,32-,33+/m1/s1
SMILES (Click to copy)
C1[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@]([H])(C)/C=C/[C@@H](COS(=O)(O)=O)C(C)C)C[C@H](O)[C@@]4([H])[C@]3(O)C[C@@H](O)[C@@]2([H])C[C@@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)C1
References
Reference
Starfish Saponins. 55. Isolation, Structure Elucidation, and Biological Activity of the Steroid Oligoglycosides From an Antarctic Starfish of the Family Asteriidae
J Nat Prod. 1998
DOI: 10.1021/np970500e
PMID: 9834144
J Nat Prod. 1998
DOI: 10.1021/np970500e
PMID: 9834144
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Asteriidae
(#7600)
Asteroidea
(#7588)
Starfish saponins. 55. Isolation, structure elucidation, and biological activity of the steroid oligoglycosides from an Antarctic starfish of the family Asteriidae.,
J Nat Prod, 1998
J Nat Prod, 1998
Pubmed ID:
9834144
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
46
Rings
5
Aromatic Rings
0
Rotatable Bonds
9
Van der Waals Molecular Volume
639.01
Topological Polar Surface Area
205.51
Hydrogen Bond Donors
7
Hydrogen Bond Acceptors
12
logP
5.92
Molar Refractivity
171.21
Admin
Created at
-
Updated at
4th Jul 2020