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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H24O11
Molecular Weight 560.505
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VIOMELLEIN

SMILES

COC1=CC2=CC3=C(C(=O)O[C@H](C)C3)C(O)=C2C(O)=C1C4=C(OC)C(=O)C5=CC6=C(C(=O)O[C@H](C)C6)C(O)=C5C4=O

InChI

InChIKey=CKVKZAJXACTIEL-GHMZBOCLSA-N
InChI=1S/C30H24O11/c1-10-5-12-7-14-9-16(38-3)21(25(33)17(14)24(32)18(12)29(36)40-10)22-27(35)20-15(23(31)28(22)39-4)8-13-6-11(2)41-30(37)19(13)26(20)34/h7-11,32-34H,5-6H2,1-4H3/t10-,11-/m1/s1

HIDE SMILES / InChI

Molecular Formula C30H24O11
Molecular Weight 560.505
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:25:14 GMT 2023
Edited
by admin
on Sat Dec 16 10:25:14 GMT 2023
Record UNII
9R5RC7QX9B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VIOMELLEIN
Common Name English
(3R,3'R)-3,3',4,4'-TETRAHYDRO-9',10,10'-TRIHYDROXY-7,7'-DIMETHOXY-3,3'-DIMETHYL(8,8'-BI-1H-NAPHTHO(2,3-C)PYRAN)-1,1',6,9-TETRONE
Systematic Name English
(8,8'-BI-1H-NAPHTHO(2,3-C)PYRAN)-1,1',6,9-TETRONE, 3,3',4,4'-TETRAHYDRO-9',10,10'-TRIHYDROXY-7,7'-DIMETHOXY-3,3'-DIMETHYL-, (3R,3'R)-
Systematic Name English
(8,8'-BI-1H-NAPHTHO(2,3-C)PYRAN)-1,1',6,9-TETRONE, 3,3',4,4'-TETRAHYDRO-9',10,10'-TRIHYDROXY-7,7'-DIMETHOXY-3,3'-DIMETHYL-, (R-(R*,R*))-
Systematic Name English
Code System Code Type Description
CAS
55625-78-0
Created by admin on Sat Dec 16 10:25:14 GMT 2023 , Edited by admin on Sat Dec 16 10:25:14 GMT 2023
PRIMARY
PUBCHEM
3033108
Created by admin on Sat Dec 16 10:25:14 GMT 2023 , Edited by admin on Sat Dec 16 10:25:14 GMT 2023
PRIMARY
EPA CompTox
DTXSID00204162
Created by admin on Sat Dec 16 10:25:14 GMT 2023 , Edited by admin on Sat Dec 16 10:25:14 GMT 2023
PRIMARY
FDA UNII
9R5RC7QX9B
Created by admin on Sat Dec 16 10:25:14 GMT 2023 , Edited by admin on Sat Dec 16 10:25:14 GMT 2023
PRIMARY