| Properties | Image |
|---|
| MNX_ID | MNXM17205 |
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| reference | metacycM:CPD-11465 |
| formula | C40H56O2 |
| global charge | 0 |
| mol weight | 568.886 |
| InChIKey | YXTRGWPAUSOLAD-HMSUWCNJSA-N |
| InChI | InChI=1S/C40H56O2/c1-32(2)18-13-21-35(5)24-16-27-36(6)25-14-22-33(3)19-11-12-20-34(4)23-15-26-37(7)28-17-29-38(8)30-31-39(41)40(9,10)42/h11-12,14-15,17-20,22-26,28-31,42H,13,16,21,27H2,1-10H3/b12-11+,22-14+,23-15+,28-17+,31-30+,33-19+,34-20+,35-24+,36-25+,37-26+,38-29+ |
| SMILES | CC(C)=CCC/C(C)=C/CC/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C=C(C)/C=C/C(=O)C(C)(C)O |
MNX internals
| InChI (mnx) | InChI=1/C40H56O2/c1-32(2)18-13-21-35(5)24-16-27-36(6)25-14-22-33(3)19-11-12-20-34(4)23-15-26-37(7)28-17-29-38(8)30-31-39(41)40(9,10)42/h11-12,14-15,17-20,22-26,28-31,42H,13,16,21,27H2,1-10H3/b12-11+,22-14+,23-15+,28-17+,31-30+,33-19+,34-20+,35-24+,36-25+,37-26+,38-29+ |
 |
| SMILES (mnx) | [CH3:1][C:32]([CH3:2])=[CH:18][CH2:13][CH2:21]/[C:35]([CH3:5])=[CH:24]/[CH2:16][CH2:27]/[C:36]([CH3:6])=[CH:25]/[CH:14]=[CH:22]/[C:33]([CH3:3])=[CH:19]/[CH:11]=[CH:12]/[CH:20]=[C:34]([CH3:4])/[CH:23]=[CH:15]/[CH:26]=[C:37]([CH3:7])/[CH:28]=[CH:17]/[CH:29]=[C:38]([CH3:8])/[CH:30]=[CH:31]/[C:39]([C:40]([CH3:9])([CH3:10])[OH:42])=[O:41] |
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