Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D03KGX
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| Former ID |
DNC008942
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| Drug Name |
Rotungenic acid
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| Synonyms |
rotungenic acid; CHEMBL493908; CHEBI:70685; SCHEMBL1051075; BDBM50253053
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
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Download2D MOL |
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| Formula |
C30H48O5
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| Canonical SMILES |
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)O)C)C)C2C1(C)O)C)C(=O)O
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| InChI |
1S/C30H48O5/c1-18-9-14-30(24(33)34)16-15-27(4)19(23(30)29(18,6)35)7-8-21-25(2)12-11-22(32)26(3,17-31)20(25)10-13-28(21,27)5/h7,18,20-23,31-32,35H,8-17H2,1-6H3,(H,33,34)/t18-,20-,21-,22+,23-,25+,26-,27-,28-,29-,30+/m1/s1
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| InChIKey |
YLHQFGOOMKJFLP-VNUPIYKRSA-N
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| PubChem Compound ID | ||||
| ChEBI ID |
CHEBI:70685
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| References | Top | |||
|---|---|---|---|---|
| REF 1 | Triterpenoids from the leaves of Diospyros kaki (persimmon) and their inhibitory effects on protein tyrosine phosphatase 1B. J Nat Prod. 2008 Oct;71(10):1775-8. | |||
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