1-[(4R,7S,8R)-5-acetyl-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-cyclohexylurea

Properties Image MNX_ID MNXM340367 reference chebi:110720 formula C26H40N4O5 global charge 0 mol weight 488.629 InChIKey ZWIPCDYWVZDKTM-RHGYRFJNSA-N InChI InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24-/m0/s1 SMILES CO[C@H]1CN(C)C(=O)C2=C(C=CC(NC(=O)NC3CCCCC3)=C2)OC[C@@H](C)N(C(C)=O)C[C@@H]1C MNX internals InChI (mnx) InChI=1/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24-/m0/s1 SMILES (mnx) [CH3:1][C@H:17]1[CH2:14][N:30]([C:19]([CH3:3])=[O:31])[C@H:18]([CH3:2])[CH2:16][O:35][C:23]2=[C:22]([CH:13]=[C:21]([NH:28][C:26](=[N:27][CH:20]3[CH2:9][CH2:7][CH2:6][CH2:8][CH2:10]3)[OH:33])[CH:11]=[CH:12]2)[C:25](=[O:32])[N:29]([CH3:4])[CH2:15][C@@H:24]1[O:34][CH3:5]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0