| Properties | Image |
|---|
| MNX_ID | MNXM17203 |
 |
| reference | metacycM:CPD-9732 |
| formula | C40H54O2 |
| global charge | 0 |
| mol weight | 566.87 |
| InChIKey | PZQIKROWSQGHQV-ROTSUDQPSA-N |
| InChI | InChI=1S/C40H54O2/c1-30(2)15-10-16-31(3)17-11-18-32(4)19-12-20-33(5)21-13-22-34(6)23-14-24-35(7)27-28-36-29-39(41)37-25-8-9-26-38(37)40(36)42/h8-9,15,17,19,21,23,25-27,29H,10-14,16,18,20,22,24,28H2,1-7H3/b31-17+,32-19+,33-21+,34-23+,35-27+ |
| SMILES | CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC1=CC(=O)C2=C(C=CC=C2)C1=O |
MNX internals
| InChI (mnx) | InChI=1/C40H54O2/c1-30(2)15-10-16-31(3)17-11-18-32(4)19-12-20-33(5)21-13-22-34(6)23-14-24-35(7)27-28-36-29-39(41)37-25-8-9-26-38(37)40(36)42/h8-9,15,17,19,21,23,25-27,29H,10-14,16,18,20,22,24,28H2,1-7H3/b31-17+,32-19+,33-21+,34-23+,35-27+ |
 |
| SMILES (mnx) | [CH3:1][C:30]([CH3:2])=[CH:15][CH2:10][CH2:16]/[C:31]([CH3:3])=[CH:17]/[CH2:11][CH2:18]/[C:32]([CH3:4])=[CH:19]/[CH2:12][CH2:20]/[C:33]([CH3:5])=[CH:21]/[CH2:13][CH2:22]/[C:34]([CH3:6])=[CH:23]/[CH2:14][CH2:24]/[C:35]([CH3:7])=[CH:27]/[CH2:28][C:36]1=[CH:29][C:39](=[O:41])[C:37]2=[CH:25][CH:8]=[CH:9][CH:26]=[C:38]2[C:40]1=[O:42] |
|