U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C56H94O28
Molecular Weight 1215.3288
Optical Activity ( - )
Defined Stereocenters 36 / 36
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of UTTROSIDE B

SMILES

C[C@H](CC[C@@]1(O)O[C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2[C@@H]1C)O[C@@H]6O[C@H](CO)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O[C@@H]8OC[C@@H](O)[C@H](O)[C@H]8O)[C@H]7O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@H](O)[C@H]6O)CO[C@@H]%10O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%10O

InChI

InChIKey=FJLUJBDSFBGOPL-YOKUEUOXSA-N
InChI=1S/C56H94O28/c1-21(19-74-49-43(70)39(66)36(63)30(15-57)77-49)7-12-56(73)22(2)34-29(84-56)14-27-25-6-5-23-13-24(8-10-54(23,3)26(25)9-11-55(27,34)4)76-51-45(72)41(68)46(33(18-60)80-51)81-53-48(83-52-44(71)40(67)37(64)31(16-58)78-52)47(38(65)32(17-59)79-53)82-50-42(69)35(62)28(61)20-75-50/h21-53,57-73H,5-20H2,1-4H3/t21-,22+,23+,24+,25-,26+,27+,28-,29+,30-,31-,32-,33-,34+,35+,36-,37-,38-,39+,40+,41-,42-,43-,44-,45-,46+,47+,48-,49-,50+,51-,52+,53+,54+,55+,56-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
UTTROSIDE B
Common Name English
.BETA.-D-GALACTOPYRANOSIDE, (3.BETA.,5.ALPHA.,22.ALPHA.,25R)-26-(.BETA.-D-GLUCOPYRANOSYLOXY)-22-HYDROXYFUROSTAN-3-YL O-.BETA.-D-GLUCOPYRANOSYL-(1->2)-O-(.BETA.-D-XYLOPYRANOSYL-(1->3))-O-.BETA.-D-GLUCOPYRANOSYL-(1->4)-
Preferred Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 795820
Created by admin on Wed Apr 02 12:47:59 GMT 2025 , Edited by admin on Wed Apr 02 12:47:59 GMT 2025
Code System Code Type Description
PUBCHEM
44566638
Created by admin on Wed Apr 02 12:47:59 GMT 2025 , Edited by admin on Wed Apr 02 12:47:59 GMT 2025
PRIMARY
CAS
88048-09-3
Created by admin on Wed Apr 02 12:47:59 GMT 2025 , Edited by admin on Wed Apr 02 12:47:59 GMT 2025
PRIMARY
FDA UNII
QK6VN86E3T
Created by admin on Wed Apr 02 12:47:59 GMT 2025 , Edited by admin on Wed Apr 02 12:47:59 GMT 2025
PRIMARY