| Properties | Image |
|---|
| MNX_ID | MNXM104691 |
 |
| reference | chebi:65805 |
| formula | C30H34O7 |
| global charge | 0 |
| mol weight | 506.595 |
| InChIKey | RPAGHTUIKDMNCP-NRFANRHFSA-N |
| InChI | InChI=1S/C30H34O7/c1-15(2)7-10-19-24(33)20-11-12-30(5,6)37-29(20)23-25(34)26(35)27(36-28(19)23)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)C(CC=C(C)C)=C(O)C2=C3OC(C)(C)CC2)C=C1O |
MNX internals
| InChI (mnx) | InChI=1/C30H34O7/c1-15(2)7-10-19-24(33)20-11-12-30(5,6)37-29(20)23-25(34)26(35)27(36-28(19)23)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:28]2[C:23](=[C:29]3[C:20](=[C:24]1[OH:33])[CH2:11][CH2:12][C:30]([CH3:5])([CH3:6])[O:37]3)[C:25](=[O:34])[C:26]([OH:35])=[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)[O:36]2 |
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