| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM1379012 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 2 |
| in models (compartimentalized) |
0 |
|
| formula | C40H54O4 |
| charge | 0 |
| mass | 598.868 |
| reference | metacycM:CPD-20426 |
| InChIKey | DNKQGUYVWUAYIE-QISQUURKSA-N |
| InChI | InChI=1S/C40H54O4/c1-27(17-13-19-29(3)21-23-33-31(5)37(43)35(41)25-39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)38(44)36(42)26-40(34,9)10/h11-24,35-37,41-43H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+ |
| SMILES | [CH3:1][C:27](=[CH:15]\[CH:11]=[CH:12]\[CH:16]=[C:28]([CH3:2])\[CH:18]=[CH:14]\[CH:20]=[C:30]([CH3:4])\[CH:22]=[CH:24]\[C:34]1=[C:32]([CH3:6])[C:38](=[O:44])[CH:36]([OH:42])[CH2:26][C:40]1([CH3:9])[CH3:10])/[CH:17]=[CH:13]/[CH:19]=[C:29]([CH3:3])/[CH:21]=[CH:23]/[C:33]1=[C:31]([CH3:5])[CH:37]([OH:43])[CH:35]([OH:41])[CH2:25][C:39]1([CH3:7])[CH3:8] |
|
