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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H28O14
Molecular Weight 612.5349
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TETRAACETYLGRANATICIN

SMILES

C[C@@H]1O[C@H]2CC(=O)O[C@H]2C3=C1C(=O)C4=C(C3=O)C(OC(C)=O)=C5[C@H]6C[C@@H](OC(C)=O)[C@@](OC(C)=O)([C@@H](C)O6)C5=C4OC(C)=O

InChI

InChIKey=GDVBLRJUTKZHGS-SYWFMFOKSA-N
InChI=1S/C30H28O14/c1-9-19-21(27-16(38-9)8-18(35)43-27)26(37)22-23(25(19)36)29(42-13(5)33)24-20(28(22)41-12(4)32)15-7-17(40-11(3)31)30(24,10(2)39-15)44-14(6)34/h9-10,15-17,27H,7-8H2,1-6H3/t9-,10+,15+,16-,17+,27+,30-/m0/s1

HIDE SMILES / InChI

Molecular Formula C30H28O14
Molecular Weight 612.5349
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 20:57:18 GMT 2025
Edited
by admin
on Mon Mar 31 20:57:18 GMT 2025
Record UNII
5773V56181
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TETRAACETYLGRANATICIN
MI  
Common Name English
8,11-ETHANOFURO(2,3-E)NAPHTHO(2,3-C:6,7-C')DIPYRAN-2,6,13(9H)-TRIONE, 7,8,12,15-TETRAKIS(ACETYLOXY)-3,3A,5,8,11,13B-HEXAHYDRO-5,9-DIMETHYL-, (3AS-(3A.ALPHA.,5.ALPHA.,8.ALPHA.,9.ALPHA.,11.BETA.,13B.ALPHA.,15S*))-
Preferred Name English
TETRAACETYLGRANATICIN [MI]
Common Name English
GRANATICIN, TETRAACETATE
Common Name English
GRANATICIN, TETRAACETYL-
Common Name English
Code System Code Type Description
CAS
1401-59-8
Created by admin on Mon Mar 31 20:57:18 GMT 2025 , Edited by admin on Mon Mar 31 20:57:18 GMT 2025
PRIMARY
EPA CompTox
DTXSID90161230
Created by admin on Mon Mar 31 20:57:18 GMT 2025 , Edited by admin on Mon Mar 31 20:57:18 GMT 2025
PRIMARY
FDA UNII
5773V56181
Created by admin on Mon Mar 31 20:57:18 GMT 2025 , Edited by admin on Mon Mar 31 20:57:18 GMT 2025
PRIMARY
MERCK INDEX
m5840
Created by admin on Mon Mar 31 20:57:18 GMT 2025 , Edited by admin on Mon Mar 31 20:57:18 GMT 2025
PRIMARY Merck Index
PUBCHEM
71586778
Created by admin on Mon Mar 31 20:57:18 GMT 2025 , Edited by admin on Mon Mar 31 20:57:18 GMT 2025
PRIMARY