Axillarine

(1R,4R,5R,6R,16R)-5,6-dihydroxy-6-[(1R)-1-hydroxyethyl]-4-propan-2-yl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]hexadec-10-ene-3,7-dione

Also Known As: Axillarine|KST-1A2520|(3r,4r,5r,13ar,13br)-4,5-dihydroxy-5-[(1r)-1-hydroxyethyl]-3-(propan-2-yl)-4,5,8,10,12,13,13a,13b-octahydro-2h-[1,6]dioxacycloundecino[2,3,4-gh]pyrrolizine-2,6(3h)-dione|(1R,4R,5R,6R,16R)-5,6-dihydroxy-6-((1R)-1-hydroxyethyl)-4-propan-2-yl-2,8-dioxa-13-azatricyclo(8.5.1.013,16)hexadec-10-ene-3,7-dione|(1R,4R,5R,6R,16R)-5,6-Dihydroxy-6-[(1R)-1-hydroxyethyl]-4-propan-2-yl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]hexadec-10-ene-3,7-dione|17,18-Dinorcrotalanan-11,15-dione, 14,19-dihydro-12,13-dihydroxy-12-(1-hydroxyethyl)-19-methyl-, (12beta,12(R),13beta,14alpha)-

Molecular Formula	C18H27NO7
Molecular Weight	369.17874 g/mol
LogP	-0.79
Topological Polar Surface Area	116.53 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	8
Rotatable Bonds	2
Exact Mass	369.17874
Heavy Atoms	26
Complexity	616.7

Chemical Identifiers

CAS Number	19637-66-2
SMILES	C[C@H]([C@]1([C@@H]([C@H](C(=O)O[C@@H]2CCN3[C@@H]2C(=CC3)COC1=O)C(C)C)O)O)O