| Properties | Image |
|---|
| MNX_ID | MNXM104690 |
 |
| reference | chebi:65804 |
| formula | C30H34O7 |
| global charge | 0 |
| mol weight | 506.595 |
| InChIKey | YIQFHSHQZCNILL-QFIPXVFZSA-N |
| InChI | InChI=1S/C30H34O7/c1-15(2)7-11-20-25(33)21(12-8-16(3)4)30-24(26(20)34)27(35)28(36)29(37-30)19-10-9-18(23(32)14-19)13-22(31)17(5)6/h7-10,14,22,31-34,36H,5,11-13H2,1-4,6H3/t22-/m0/s1 |
| SMILES | C=C(C)[C@@H](O)CC1=CC=C(C2=C(O)C(=O)C3=C(O)C(CC=C(C)C)=C(O)C(CC=C(C)C)=C3O2)C=C1O |
MNX internals
| InChI (mnx) | InChI=1/C30H34O7/c1-15(2)7-11-20-25(33)21(12-8-16(3)4)30-24(26(20)34)27(35)28(36)29(37-30)19-10-9-18(23(32)14-19)13-22(31)17(5)6/h7-10,14,22,31-34,36H,5,11-13H2,1-4,6H3/t22-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:15]([CH3:2])=[CH:7][CH2:11][C:20]1=[C:25]([OH:33])[C:21]([CH2:12][CH:8]=[C:16]([CH3:3])[CH3:4])=[C:30]2[C:24](=[C:26]1[OH:34])[C:27](=[O:35])[C:28]([OH:36])=[C:29]([C:19]1=[CH:14][C:23]([OH:32])=[C:18]([CH2:13][C@@H:22]([C:17](=[CH2:5])[CH3:6])[OH:31])[CH:9]=[CH:10]1)[O:37]2 |
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