| Properties | Image |
|---|
| MNX_ID | MNXM106367 |
 |
| reference | chebi:66644 |
| formula | C30H34O5 |
| global charge | 0 |
| mol weight | 474.597 |
| InChIKey | WWMWKWWJSMMNPL-SANMLTNESA-N |
| InChI | InChI=1S/C30H34O5/c1-17(2)7-9-19-13-21(14-20-11-12-30(5,6)35-28(19)20)26-16-25(33)27-24(32)15-23(31)22(29(27)34-26)10-8-18(3)4/h7-8,11-15,26,31-32H,9-10,16H2,1-6H3/t26-/m0/s1 |
| SMILES | CC(C)=CCC1=CC([C@@H]2CC(=O)C3=C(O)C=C(O)C(CC=C(C)C)=C3O2)=CC2=C1OC(C)(C)C=C2 |
MNX internals
| InChI (mnx) | InChI=1/C30H34O5/c1-17(2)7-9-19-13-21(14-20-11-12-30(5,6)35-28(19)20)26-16-25(33)27-24(32)15-23(31)22(29(27)34-26)10-8-18(3)4/h7-8,11-15,26,31-32H,9-10,16H2,1-6H3/t26-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:17]([CH3:2])=[CH:7][CH2:9][C:19]1=[C:28]2[C:20](=[CH:14][C:21]([C@@H:26]3[CH2:16][C:25](=[O:33])[C:27]4=[C:24]([OH:32])[CH:15]=[C:23]([OH:31])[C:22]([CH2:10][CH:8]=[C:18]([CH3:3])[CH3:4])=[C:29]4[O:34]3)=[CH:13]1)[CH:11]=[CH:12][C:30]([CH3:5])([CH3:6])[O:35]2 |
|