| Properties | Image |
| MNX_ID | MNXM736626 |
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| reference | chebi:80177 |
| formula | C40H56O3 |
| global charge | 0 |
| mol weight | 584.885 |
| InChIKey | JJPMVSRTRMLHST-XDLIQHAKSA-N |
| InChI | InChI=1S/C40H56O3/c1-30(18-13-20-32(3)21-15-23-34(5)25-27-38(42)40(9,10)43)16-11-12-17-31(2)19-14-22-33(4)24-26-37-35(6)28-36(41)29-39(37,7)8/h11-27,36,38,41-43H,28-29H2,1-10H3/b12-11+,18-13+,19-14+,21-15+,26-24+,27-25+,30-16+,31-17+,32-20+,33-22+,34-23+/t36-,38+/m1/s1 |
| SMILES | CC1=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)/C=C/[C@H](O)C(C)(C)O)C(C)(C)C[C@H](O)C1 |
MNX internals
| InChI (mnx) | InChI=1/C40H56O3/c1-30(18-13-20-32(3)21-15-23-34(5)25-27-38(42)40(9,10)43)16-11-12-17-31(2)19-14-22-33(4)24-26-37-35(6)28-36(41)29-39(37,7)8/h11-27,36,38,41-43H,28-29H2,1-10H3/b12-11+,18-13+,19-14+,21-15+,26-24+,27-25+,30-16+,31-17+,32-20+,33-22+,34-23+/t36-,38+/m1/s1 |
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| SMILES (mnx) | [CH3:1][C:30](=[CH:16]\[CH:11]=[CH:12]\[CH:17]=[C:31]([CH3:2])\[CH:19]=[CH:14]\[CH:22]=[C:33]([CH3:4])\[CH:24]=[CH:26]\[C:37]1=[C:35]([CH3:6])[CH2:28][C@@H:36]([OH:41])[CH2:29][C:39]1([CH3:7])[CH3:8])/[CH:18]=[CH:13]/[CH:20]=[C:32]([CH3:3])/[CH:21]=[CH:15]/[CH:23]=[C:34]([CH3:5])/[CH:25]=[CH:27]/[C@@H:38]([C:40]([CH3:9])([CH3:10])[OH:43])[OH:42] |
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