| 2D Structure | |
| CID | 386952 |
| IUPAC Name | (8S,9R,13R,14S,16R,17R)-17-[(2R)-2,6-dihydroxy-6-methyl-3-oxoheptan-2-yl]-3,16-dihydroxy-4,9,13,14-tetramethyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-12,15,16,17-tetrahydro-8H-cyclopenta[a]phenanthren-11-one |
| InChI | InChI=1S/C35H50O12/c1-16-17-8-9-22-32(4)13-19(37)29(35(7,45)23(38)10-11-31(2,3)44)33(32,5)14-24(39)34(22,6)18(17)12-20(25(16)40)46-30-28(43)27(42)26(41)21(15-36)47-30/h8-9,12,19,21-22,26-30,36-37,40-45H,10-11,13-15H2,1-7H3/t19-,21?,22+,26?,27?,28?,29+,30?,32+,33-,34+,35+/m1/s1 |
| InChI Key | JARDNXVRGXYQOK-FKPJQOOCSA-N |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C35H50O12 |
| Molecular Weight | 662.8 |
| synonyms | ['NSC680114', 'Cayaponoside C5b', 'CHEMBL1986249', 'NSC-680114', 'NCI60_028589'] |
From Pubchem