| Properties | Image |
|---|
| MNX_ID | MNXM104692 |
 |
| reference | chebi:65806 |
| formula | C30H34O7 |
| global charge | 0 |
| mol weight | 506.595 |
| InChIKey | LGOMXMSCNFANHV-NRFANRHFSA-N |
| InChI | InChI=1S/C30H34O7/c1-15(2)7-10-19-24(33)23-25(34)26(35)27(36-29(23)20-11-12-30(5,6)37-28(19)20)18-9-8-17(22(32)14-18)13-21(31)16(3)4/h7-9,14,21,31-33,35H,3,10-13H2,1-2,4-6H3/t21-/m0/s1 |
| SMILES | C=C(C)[C@@H](O)CC1=CC=C(C2=C(O)C(=O)C3=C(O2)C2=C(OC(C)(C)CC2)C(CC=C(C)C)=C3O)C=C1O |
MNX internals
| InChI (mnx) | InChI=1/C30H34O7/c1-15(2)7-10-19-24(33)23-25(34)26(35)27(36-29(23)20-11-12-30(5,6)37-28(19)20)18-9-8-17(22(32)14-18)13-21(31)16(3)4/h7-9,14,21,31-33,35H,3,10-13H2,1-2,4-6H3/t21-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:15]([CH3:2])=[CH:7][CH2:10][C:19]1=[C:24]([OH:33])[C:23]2=[C:29]([C:20]3=[C:28]1[O:37][C:30]([CH3:5])([CH3:6])[CH2:12][CH2:11]3)[O:36][C:27]([C:18]1=[CH:14][C:22]([OH:32])=[C:17]([CH2:13][C@@H:21]([C:16](=[CH2:3])[CH3:4])[OH:31])[CH:8]=[CH:9]1)=[C:26]([OH:35])[C:25]2=[O:34] |
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