| CAS Number | 195883-06-8 |
| Catalog Number | AG00AMBV(AGN-PC-0QO0ZQ) |
| Chemical Name | Omtriptolide |
| IUPAC Name | 4-[[(1S,2S,4S,5S,7S,8R,9R,11S,13S)-1-methyl-17-oxo-7-propan-2-yl-3,6,10,16-tetraoxaheptacyclo[11.7.0.02,4.02,9.05,7.09,11.014,18]icos-14(18)-en-8-yl]oxy]-4-oxobutanoic acid |
| InChI | InChI=1S/C24H28O9/c1-10(2)22-17(32-22)18-24(33-18)21(3)7-6-11-12(9-29-19(11)28)13(21)8-14-23(24,31-14)20(22)30-16(27)5-4-15(25)26/h10,13-14,17-18,20H,4-9H2,1-3H3,(H,25,26)/t13-,14-,17-,18-,20+,21-,22-,23+,24+/m0/s1 |
| InChI Key | HROMYAWHLUOUPY-AHCCQAQQSA-N |
| MDL Number | MFCD09954137 |
| Molecular Formula | C24H28O9 |
| Molecular Weight | 460.4737 |
| SMILES | C[C@]12CCC3C(=O)OCC=3[C@]1([H])C[C@@H]1O[C@]31[C@@H]([C@@]1(C(C)C)O[C@H]1[C@@H]1O[C@]231)OC(=O)CCC(=O)O |
| UNII | D36ELM729P |
| Synonyms | omtriptolide,
PG490-88,
Omtriptolide,
195883-06-8,
UNII-D36ELM729P,
D36ELM729P,
Omtriptolide [INN],
PG490-88,
YM 262,
CHEMBL2110669,
SCHEMBL16312527,
ZINC14128458,
CS-6982,
HY-16363,
883O068,
CID6918522,
CID 6918522,
|