| Properties | Image |
|---|
| MNX_ID | MNXM727389 |
 |
| reference | metacycM:CPD-9724 |
| formula | C41H56O2 |
| global charge | 0 |
| mol weight | 580.897 |
| InChIKey | PFRQBZFETXBLTP-RCIYGOBDSA-N |
| InChI | InChI=1S/C41H56O2/c1-30(2)16-11-17-31(3)18-12-19-32(4)20-13-21-33(5)22-14-23-34(6)24-15-25-35(7)28-29-37-36(8)40(42)38-26-9-10-27-39(38)41(37)43/h9-10,16,18,20,22,24,26-28H,11-15,17,19,21,23,25,29H2,1-8H3/b31-18+,32-20+,33-22+,34-24+,35-28+ |
| SMILES | CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC1=C(C)C(=O)C2=C(C=CC=C2)C1=O |
MNX internals
| InChI (mnx) | InChI=1/C41H56O2/c1-30(2)16-11-17-31(3)18-12-19-32(4)20-13-21-33(5)22-14-23-34(6)24-15-25-35(7)28-29-37-36(8)40(42)38-26-9-10-27-39(38)41(37)43/h9-10,16,18,20,22,24,26-28H,11-15,17,19,21,23,25,29H2,1-8H3/b31-18+,32-20+,33-22+,34-24+,35-28+ |
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| SMILES (mnx) | [CH3:1][C:30]([CH3:2])=[CH:16][CH2:11][CH2:17]/[C:31]([CH3:3])=[CH:18]/[CH2:12][CH2:19]/[C:32]([CH3:4])=[CH:20]/[CH2:13][CH2:21]/[C:33]([CH3:5])=[CH:22]/[CH2:14][CH2:23]/[C:34]([CH3:6])=[CH:24]/[CH2:15][CH2:25]/[C:35]([CH3:7])=[CH:28]/[CH2:29][C:37]1=[C:36]([CH3:8])[C:40](=[O:42])[C:38]2=[CH:26][CH:9]=[CH:10][CH:27]=[C:39]2[C:41]1=[O:43] |
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