Ingredients

Withametelin e

C28H38O7

Basic Information

Grouped by core information, identifiers, and descriptions.

Name: Withametelin e
Molecular Formula: C28H38O7
Molecular Weight: No data
Canonical SMILES: CC1=C(C(=O)OC(C1)C(C)C2CCC3C2(C(CC4C3C5C(O5)C6(C4(C(=O)C=CC6)C)O)O)C)CO
Isomeric SMILES: CC1=C(C(=O)O[C@H](C1)[C@@H](C)[C@H]2CC[C@@H]3[C@@]2([C@@H](C[C@H]4[C@H]3[C@H]5[C@H](O5)[C@@]6([C@@]4(C(=O)C=CC6)C)O)O)C)CO
InChI: InChI=1S/C28H38O7/c1-13-10-19(34-25(32)15(13)12-29)14(2)16-7-8-17-22-18(11-21(31)26(16,17)3)27(4)20(30)6-5-9-28(27,33)24-23(22)35-24/h5-6,14,16-19,21-24,29,31,33H,7-12H2,1-4H3/t14-,16+,17-,18-,19+,21+,22-,23-,24-,26+,27-,28-/m0/s1
Oral Bioavailability: 23.982
Drug Likeness: 0.414
DL Score: No data
Caco-2 Permeability: No data
ALogP: No data
Bioavailability Score: No data