IBD Research Resource Center

BioID	bio200459
Name	DIHYDROTACHYSTEROL
ChEMBL ID	CHEMBL2356023
Molecular Formula	C28H46O
Molecular Weight	398.68
Molecular Weight (Monoisotopic)	398.3549
Type	Small molecule
Max Phase	Phase 4
Target ID	Tar81
Target Name	None
Synonyms	A.T. 10\|DICHYSTEROL\|DIHIDROTAQUISTEROL\|DIHYDRAL\|DIHYDROTACHYSTEROL\|DIHYDROTACHYSTEROL 2\|DIHYDROTACHYSTEROL2\|DYGRATYL\|TACHYROL\|TACHYSTEROL DIHYDRO DERIVATIVE\|VITAMIN D1
Smiles	CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2/C(=C/C=C3\C[C@@H](O)CC[C@@H]3C)CCC[C@]12C
Inchi	InChI=1S/C28H46O/c1-19(2)20(3)9-10-22(5)26-15-16-27-23(8-7-17-28(26,27)6)12-13-24-18-25(29)14-11-21(24)4/h9-10,12-13,19-22,25-27,29H,7-8,11,14-18H2,1-6H3/b10-9+,23-12+,24-13+/t20-,21-,22+,25-,26+,27-,28+/m0/s1
Inchi Key	ILYCWAKSDCYMBB-OPCMSESCSA-N
Molecular Species	NEUTRAL
Targets	67.0
Bioactivities	84.0
Np Likeness Score	2.43
Records Key	['SID50111742', 'DIHYDROTACHYSTEROL', 'DIHYDROTACHYSTEROL', 'SID29217905', 'SID144205894', 'dihydrotachysterol', 'dihydrotachysterol', 'DIHYDROTACHYSTEROL', 'DIHYDROTACHYSTEROL', 'dihydrotachysterol', 'dihydrotachysterol']
Records Name	['SID50111742', 'DIHYDROTACHYSTEROL', 'DIHYDROTACHYSTEROL', 'SID29217905', 'SID144205894', 'dihydrotachysterol', 'dihydrotachysterol', 'DIHYDROTACHYSTEROL', 'DIHYDROTACHYSTEROL', 'dihydrotachysterol', 'dihydrotachysterol']
Withdrawn Flag	False
Orphan	0