Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C30H21NO9 |
| Molecular Weight | 539.489 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 2 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC(=O)C2=C(O)C3=C(C(=O)[C@]4(CCC5=CC6=C(C(=O)NC(\C=C\C=C\C)=C6)C(O)=C45)C3=O)C(O)=C2C1=O
InChI
InChIKey=BZONSJUONOFNNP-MHSJTTIKSA-N
InChI=1S/C30H21NO9/c1-3-4-5-6-14-10-13-9-12-7-8-30(22(12)26(36)17(13)29(39)31-14)27(37)20-21(28(30)38)25(35)19-18(24(20)34)15(32)11-16(40-2)23(19)33/h3-6,9-11,34-36H,7-8H2,1-2H3,(H,31,39)/b4-3+,6-5+/t30-/m0/s1
| Molecular Formula | C30H21NO9 |
| Molecular Weight | 539.489 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 2 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 22:46:03 GMT 2025
by
admin
on
Mon Mar 31 22:46:03 GMT 2025
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| Record UNII |
WSY58QC629
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| Record Status |
Validated (UNII)
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| Record Version |
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9937086
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WSY58QC629
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admin on Mon Mar 31 22:46:03 GMT 2025 , Edited by admin on Mon Mar 31 22:46:03 GMT 2025
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m5566
Created by
admin on Mon Mar 31 22:46:03 GMT 2025 , Edited by admin on Mon Mar 31 22:46:03 GMT 2025
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PRIMARY | Merck Index | ||
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DTXSID001043900
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admin on Mon Mar 31 22:46:03 GMT 2025 , Edited by admin on Mon Mar 31 22:46:03 GMT 2025
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305263
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80455-68-1
Created by
admin on Mon Mar 31 22:46:03 GMT 2025 , Edited by admin on Mon Mar 31 22:46:03 GMT 2025
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SALT/SOLVATE -> PARENT |
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