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Untitled Document
Untitled Document
Untitled Document
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GAMBOGIC-ACID
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| Chemical Formula |
: C38-H44-O8 |
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| IUPAC Name |
: 3a,4,5,7-tetrahydro-8-hydroxy-alpha,3,3,11-tetramethyl-13-(3-methyl-2-butenyl)-11-(4-methyl-3-pentenyl)-7,15-dioxo-, (Z)- 1,5-Methano-1H,3H,11H-furo(3,4-g)pyrano(3,2-b)xanthene-1-crotonic acid |
| CAS Registry Number / CID |
: cid-6444190 |
| SMILES Notation |
: CC(=CCCC1(C=CC2=C(O1)C(=C3C(=C2O)C(=O)C4=CC5CC6C4(O3)C(C5=O)(OC6(C)C)CC=C(C)C(=O)O)CC=C(C)C)C)C |
| Molecular weight |
: 628.75116 [g/mol] |
| x log P |
: 5.2 |
| H Bond Donor |
: 8 |
| H Bond Acceptor |
: 2 |
Molecular Structure |
| Rotatable bond count |
: 8 |
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Biological Activities |
Drug likeness / ADMET
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Constituents
(Alphabetical order) |
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