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

Details

Stereochemistry EPIMERIC
Molecular Formula C21H22O6
Molecular Weight 370.3958
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CABENEGRIN A-II

SMILES

[H][C@@]12COC3=CC(O)=C(CCC(C)CO)C=C3[C@]1([H])OC4=C2C=C5OCOC5=C4

InChI

InChIKey=QZBPWZWWRPDXGM-ZCUNXJIWSA-N
InChI=1S/C21H22O6/c1-11(8-22)2-3-12-4-14-17(6-16(12)23)24-9-15-13-5-19-20(26-10-25-19)7-18(13)27-21(14)15/h4-7,11,15,21-23H,2-3,8-10H2,1H3/t11?,15-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H22O6
Molecular Weight 370.3958
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 2 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:50:37 GMT 2023
Edited
by admin
on Sat Dec 16 08:50:37 GMT 2023
Record UNII
6D0K52WN5Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CABENEGRIN A-II
MI  
Common Name English
6H-(1,3)DIOXOLO(5,6)BENZOFURO(3,2-C)(1)BENZOPYRAN-2-BUTANOL, 6A,12A-DIHYDRO-3-HYDROXY-.BETA.-METHYL-, (6AR,12AR)-
Systematic Name English
CABENEGRIN A II
Common Name English
(-)-CABENEGRIN A II
Common Name English
CABENEGRIN A-II [MI]
Common Name English
Code System Code Type Description
PUBCHEM
13292118
Created by admin on Sat Dec 16 08:50:37 GMT 2023 , Edited by admin on Sat Dec 16 08:50:37 GMT 2023
PRIMARY
MERCK INDEX
m2875
Created by admin on Sat Dec 16 08:50:37 GMT 2023 , Edited by admin on Sat Dec 16 08:50:37 GMT 2023
PRIMARY Merck Index
FDA UNII
6D0K52WN5Y
Created by admin on Sat Dec 16 08:50:37 GMT 2023 , Edited by admin on Sat Dec 16 08:50:37 GMT 2023
PRIMARY
CAS
84297-60-9
Created by admin on Sat Dec 16 08:50:37 GMT 2023 , Edited by admin on Sat Dec 16 08:50:37 GMT 2023
PRIMARY