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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H18O10
Molecular Weight 514.4365
Optical Activity NONE
Additional Stereochemistry Yes
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0
Stereo Comments AXIAL, R

SHOW SMILES / InChI
Structure of USTILAGINOIDIN A

SMILES

CC1=CC(=O)C2=C(O)C3=C(O)C=C(O)C(=C3C=C2O1)C4=C5C=C6OC(C)=CC(=O)C6=C(O)C5=C(O)C=C4O

InChI

InChIKey=GCSBLYZTGOQVPI-UHFFFAOYSA-N
InChI=1S/C28H18O10/c1-9-3-13(29)25-19(37-9)5-11-21(15(31)7-17(33)23(11)27(25)35)22-12-6-20-26(14(30)4-10(2)38-20)28(36)24(12)18(34)8-16(22)32/h3-8,31-36H,1-2H3

HIDE SMILES / InChI

Molecular Formula C28H18O10
Molecular Weight 514.4365
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:43:54 GMT 2023
Edited
by admin
on Fri Dec 15 19:43:54 GMT 2023
Record UNII
PV0Q778466
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
USTILAGINOIDIN A
Common Name English
(9,9'-BI-4H-NAPHTHO(2,3-B)PYRAN)-4,4'-DIONE, 5,5',6,6',8,8'-HEXAHYDROXY-2,2'-DIMETHYL-, (R)-
Common Name English
(9,9'-BI-4H-NAPHTHO(2,3-B)PYRAN)-4,4'-DIONE, 5,5',6,6',8,8'-HEXAHYDROXY-2,2'-DIMETHYL-, (9R)-
Common Name English
(9,9'-BI-4H-NAPHTHO(2,3-B)PYRAN)-4,4'-DIONE, 5,5',6,6',8,8'-HEXAHYDROXY-2,2'-DIMETHYL-
Systematic Name English
(-)-USTILAGINOIDIN A
Common Name English
USTILAGINOIDINE A
Common Name English
Code System Code Type Description
CHEBI
145840
Created by admin on Fri Dec 15 19:43:54 GMT 2023 , Edited by admin on Fri Dec 15 19:43:54 GMT 2023
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FDA UNII
PV0Q778466
Created by admin on Fri Dec 15 19:43:54 GMT 2023 , Edited by admin on Fri Dec 15 19:43:54 GMT 2023
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PUBCHEM
5315142
Created by admin on Fri Dec 15 19:43:54 GMT 2023 , Edited by admin on Fri Dec 15 19:43:54 GMT 2023
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CAS
3692-07-7
Created by admin on Fri Dec 15 19:43:54 GMT 2023 , Edited by admin on Fri Dec 15 19:43:54 GMT 2023
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EPA CompTox
DTXSID90190409
Created by admin on Fri Dec 15 19:43:54 GMT 2023 , Edited by admin on Fri Dec 15 19:43:54 GMT 2023
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