| Properties | Image |
|---|
| MNX_ID | MNXM8528 |
 |
| reference | chebi:64806 |
| formula | C45H64O2 |
| global charge | 0 |
| mol weight | 637.005 |
| InChIKey | UFZDIMBXTVRBDS-SSQLMYNASA-N |
| InChI | InChI=1S/C45H64O2/c1-34(2)17-11-18-35(3)19-12-20-36(4)21-13-22-37(5)23-14-24-38(6)25-15-26-39(7)27-16-28-40(8)31-32-41-33-44(46)42-29-9-10-30-43(42)45(41)47/h9-10,17,19,21,23,25,27,29-31,33,46-47H,11-16,18,20,22,24,26,28,32H2,1-8H3/b35-19+,36-21+,37-23+,38-25+,39-27+,40-31+ |
| SMILES | CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC1=CC(O)=C2C=CC=CC2=C1O |
MNX internals
| InChI (mnx) | InChI=1/C45H64O2/c1-34(2)17-11-18-35(3)19-12-20-36(4)21-13-22-37(5)23-14-24-38(6)25-15-26-39(7)27-16-28-40(8)31-32-41-33-44(46)42-29-9-10-30-43(42)45(41)47/h9-10,17,19,21,23,25,27,29-31,33,46-47H,11-16,18,20,22,24,26,28,32H2,1-8H3/b35-19+,36-21+,37-23+,38-25+,39-27+,40-31+ |
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| SMILES (mnx) | [CH3:1][C:34]([CH3:2])=[CH:17][CH2:11][CH2:18]/[C:35]([CH3:3])=[CH:19]/[CH2:12][CH2:20]/[C:36]([CH3:4])=[CH:21]/[CH2:13][CH2:22]/[C:37]([CH3:5])=[CH:23]/[CH2:14][CH2:24]/[C:38]([CH3:6])=[CH:25]/[CH2:15][CH2:26]/[C:39]([CH3:7])=[CH:27]/[CH2:16][CH2:28]/[C:40]([CH3:8])=[CH:31]/[CH2:32][C:41]1=[C:45]([OH:47])[C:43]2=[CH:30][CH:10]=[CH:9][CH:29]=[C:42]2[C:44]([OH:46])=[CH:33]1 |
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