Ingredients

(e,4s,6r)-4-hydroxy-2-methyl-6-[(3s,5r,7s,10s,12s,13r,14r,17r)-3,7,12-trihydroxy-4,4,10,13,14-pentamethyl-11,15-dioxo-2,3,5,6,7,12,16,17-octahydro-1h-cyclopenta[a]phenanthren-17-yl]hept-2-enoic acid

C30H44O8

Basic Information

Grouped by core information, identifiers, and descriptions.

Name: (e,4s,6r)-4-hydroxy-2-methyl-6-[(3s,5r,7s,10s,12s,13r,14r,17r)-3,7,12-trihydroxy-4,4,10,13,14-pentamethyl-11,15-dioxo-2,3,5,6,7,12,16,17-octahydro-1h-cyclopenta[a]phenanthren-17-yl]hept-2-enoic acid
Molecular Formula: C30H44O8
Molecular Weight: No data
Canonical SMILES: CC(CC(C=C(C)C(=O)O)O)C1CC(=O)C2(C1(C(C(=O)C3=C2C(CC4C3(CCC(C4(C)C)O)C)O)O)C)C
Isomeric SMILES: C[C@H](C[C@@H](/C=C(\C)/C(=O)O)O)[C@H]1CC(=O)[C@@]2([C@@]1([C@@H](C(=O)C3=C2[C@H](C[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O)C)O)O)C)C
InChI: InChI=1S/C30H44O8/c1-14(10-16(31)11-15(2)26(37)38)17-12-21(34)30(7)22-18(32)13-19-27(3,4)20(33)8-9-28(19,5)23(22)24(35)25(36)29(17,30)6/h11,14,16-20,25,31-33,36H,8-10,12-13H2,1-7H3,(H,37,38)/b15-11+/t14-,16+,17-,18+,19+,20+,25-,28+,29+,30+/m1/s1
Oral Bioavailability: 18.561
Drug Likeness: 0.339
DL Score: No data
Caco-2 Permeability: No data
ALogP: No data
Bioavailability Score: No data