| Properties | Image |
|---|
| MNX_ID | MNXM100797 |
 |
| reference | chebi:66200 |
| formula | C30H28O6 |
| global charge | 0 |
| mol weight | 484.548 |
| InChIKey | QBEVDWJGVNNOGT-NTWNTOQNSA-N |
| InChI | InChI=1S/C30H28O6/c1-30(2)29(36-26(33)16-13-19-9-5-3-6-10-19)22(18-34-30)27-23(31)15-14-21-24(32)17-25(35-28(21)27)20-11-7-4-8-12-20/h3-16,22,25,29,31H,17-18H2,1-2H3/b16-13+/t22-,25+,29+/m1/s1 |
| SMILES | CC1(C)OC[C@H](C2=C(O)C=CC3=C2O[C@H](C2=CC=CC=C2)CC3=O)[C@@H]1OC(=O)/C=C/C1=CC=CC=C1 |
MNX internals
| InChI (mnx) | InChI=1/C30H28O6/c1-30(2)29(36-26(33)16-13-19-9-5-3-6-10-19)22(18-34-30)27-23(31)15-14-21-24(32)17-25(35-28(21)27)20-11-7-4-8-12-20/h3-16,22,25,29,31H,17-18H2,1-2H3/b16-13+/t22-,25+,29+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C:30]1([CH3:2])[C@@H:29]([O:36][C:26](/[CH:16]=[CH:13]/[C:19]2=[CH:9][CH:5]=[CH:3][CH:6]=[CH:10]2)=[O:33])[C@@H:22]([C:27]2=[C:23]([OH:31])[CH:15]=[CH:14][C:21]3=[C:28]2[O:35][C@H:25]([C:20]2=[CH:11][CH:7]=[CH:4][CH:8]=[CH:12]2)[CH2:17][C:24]3=[O:32])[CH2:18][O:34]1 |
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