| Properties | Image |
|---|
| MNX_ID | MNXM147714 |
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| reference | metacycM:CPD-16523 |
| formula | C51H78O2 |
| global charge | 0 |
| mol weight | 723.183 |
| InChIKey | PZRKHNNLPWSLFO-XWEAJCOCSA-N |
| InChI | InChI=1S/C51H78O2/c1-40(2)19-11-20-41(3)21-12-22-42(4)23-13-24-43(5)25-14-26-44(6)27-15-28-45(7)29-16-30-46(8)31-17-32-47(9)33-18-34-48(10)35-36-49-39-50(52)37-38-51(49)53/h19,21,23,25,27,29,31,33,35,37-39,52-53H,11-18,20,22,24,26,28,30,32,34,36H2,1-10H3/b41-21+,42-23+,43-25+,44-27+,45-29+,46-31+,47-33+,48-35+ |
| 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/CC/C(C)=C/CC/C(C)=C/CC1=C(O)C=CC(O)=C1 |
MNX internals
| InChI (mnx) | InChI=1/C51H78O2/c1-40(2)19-11-20-41(3)21-12-22-42(4)23-13-24-43(5)25-14-26-44(6)27-15-28-45(7)29-16-30-46(8)31-17-32-47(9)33-18-34-48(10)35-36-49-39-50(52)37-38-51(49)53/h19,21,23,25,27,29,31,33,35,37-39,52-53H,11-18,20,22,24,26,28,30,32,34,36H2,1-10H3/b41-21+,42-23+,43-25+,44-27+,45-29+,46-31+,47-33+,48-35+ |
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| SMILES (mnx) | [CH3:1][C:40]([CH3:2])=[CH:19][CH2:11][CH2:20]/[C:41]([CH3:3])=[CH:21]/[CH2:12][CH2:22]/[C:42]([CH3:4])=[CH:23]/[CH2:13][CH2:24]/[C:43]([CH3:5])=[CH:25]/[CH2:14][CH2:26]/[C:44]([CH3:6])=[CH:27]/[CH2:15][CH2:28]/[C:45]([CH3:7])=[CH:29]/[CH2:16][CH2:30]/[C:46]([CH3:8])=[CH:31]/[CH2:17][CH2:32]/[C:47]([CH3:9])=[CH:33]/[CH2:18][CH2:34]/[C:48]([CH3:10])=[CH:35]/[CH2:36][C:49]1=[C:51]([OH:53])[CH:38]=[CH:37][C:50]([OH:52])=[CH:39]1 |
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