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Details

Stereochemistry UNKNOWN
Molecular Formula C22H26O9
Molecular Weight 434.4364
Optical Activity UNSPECIFIED
Defined Stereocenters 11 / 11
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BIELSCHOWSKYSIN

SMILES

CC(=O)O[C@@H]1C[C@@H]2[C@H](O[C@H](O)C2=C)[C@@]3(O)O[C@@]4(C=C3C)[C@H]5[C@@H]6[C@H](C[C@]5(C)O)OC(=O)[C@]146

InChI

InChIKey=BILSMHBWRCOPGJ-RASNQSQESA-N
InChI=1S/C22H26O9/c1-8-6-20-15-14-12(7-19(15,4)26)29-18(25)21(14,20)13(28-10(3)23)5-11-9(2)17(24)30-16(11)22(8,27)31-20/h6,11-17,24,26-27H,2,5,7H2,1,3-4H3/t11-,12-,13+,14-,15-,16-,17-,19-,20-,21+,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H26O9
Molecular Weight 434.4364
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 11 / 11
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 00:09:24 GMT 2025
Edited
by admin
on Wed Apr 02 00:09:24 GMT 2025
Record UNII
R7M3Y4C8BK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BIELSCHOWSKYSIN [MI]
Preferred Name English
BIELSCHOWSKYSIN
Common Name English
7H-4B,7-EPOXY-1H,3H-2,8-DIOXACYCLOPENTA(6',7')CYCLONONA(1',2':1,4)CYCLOBUTA(1,2,3-CD)PENTALEN-1-ONE, 12-(ACETYLOXY)-2A,4,4A,7A,9,10,10A,11,12,12B-DECAHYDRO-4,7,9-TRIHYDROXY-4,6-DIMETHYL-10-METHYLENE-, (2AR,4R,4AR,4BR,7R,7AR,9R,10AR,12S,12AS,12BR)-REL-(-)-
Systematic Name English
Code System Code Type Description
PUBCHEM
11201358
Created by admin on Wed Apr 02 00:09:24 GMT 2025 , Edited by admin on Wed Apr 02 00:09:24 GMT 2025
PRIMARY
CAS
697298-90-1
Created by admin on Wed Apr 02 00:09:24 GMT 2025 , Edited by admin on Wed Apr 02 00:09:24 GMT 2025
PRIMARY
MERCK INDEX
m11786
Created by admin on Wed Apr 02 00:09:24 GMT 2025 , Edited by admin on Wed Apr 02 00:09:24 GMT 2025
PRIMARY
FDA UNII
R7M3Y4C8BK
Created by admin on Wed Apr 02 00:09:24 GMT 2025 , Edited by admin on Wed Apr 02 00:09:24 GMT 2025
PRIMARY