24,25-epoxytirucall-7-ene-3,23-dione

Properties Image MNX_ID MNXM101699 reference chebi:69004 formula C30H46O3 global charge 0 mol weight 454.695 InChIKey LLEVBDQGRCWBIO-OBDUWLSNSA-N InChI InChI=1S/C30H46O3/c1-18(17-22(31)25-27(4,5)33-25)19-11-15-30(8)21-9-10-23-26(2,3)24(32)13-14-28(23,6)20(21)12-16-29(19,30)7/h9,18-20,23,25H,10-17H2,1-8H3/t18?,19-,20-,23-,25-,28+,29-,30+/m0/s1 SMILES CC(CC(=O)[C@@H]1OC1(C)C)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC[C@@]12C MNX internals InChI (mnx) InChI=1/C30H46O3/c1-18(17-22(31)25-27(4,5)33-25)19-11-15-30(8)21-9-10-23-26(2,3)24(32)13-14-28(23,6)20(21)12-16-29(19,30)7/h9,18-20,23,25H,10-17H2,1-8H3/t18?,19-,20-,23-,25-,28+,29-,30+/m0/s1 SMILES (mnx) [CH3:1][CH:18]([CH2:17][C:22]([C@H:25]1[C:27]([CH3:4])([CH3:5])[O:33]1)=[O:31])[C@@H:19]1[CH2:11][CH2:15][C@:30]2([CH3:8])[C:21]3=[CH:9][CH2:10][C@H:23]4[C:26]([CH3:2])([CH3:3])[C:24](=[O:32])[CH2:13][CH2:14][C@:28]4([CH3:6])[C@H:20]3[CH2:12][CH2:16][C@@:29]12[CH3:7]

Parent-child relations graph

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