| Properties | Image | Occurences in reactions |
MNX_ID | MNXM1372136 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C22H31NO5 |
charge | 0 |
mass | 389.492 |
reference | metacycM:CPD-17998 |
InChIKey | IIZSEOKGOHTBLK-UHFFFAOYSA-N |
InChI | InChI=1S/C22H31NO5/c1-11-5-7-14-13(9-11)6-8-15-17-12(2)28-22(27)16(10-24)23(4)19(26)21(17,22)18(25)20(14,15)3/h6,8,11-17,24,27H,5,7,9-10H2,1-4H3 |
SMILES | [CH3:1][CH:11]1[CH2:5][CH2:7][CH:14]2[CH:13]([CH:6]=[CH:8][CH:15]3[CH:17]4[CH:12]([CH3:2])[O:28][C:22]5([OH:27])[CH:16]([CH2:10][OH:24])[N:23]([CH3:4])[C:19](=[O:26])[C:21]45[C:18](=[O:25])[C:20]23[CH3:3])[CH2:9]1 |
|