| Properties | Image |
|---|
| MNX_ID | MNXM149251 |
 |
| reference | chebi:75673 |
| formula | C30H26O13 |
| global charge | 0 |
| mol weight | 594.525 |
| InChIKey | SNJZSALXDDQVRR-DJUYLCBNSA-N |
| InChI | InChI=1S/C30H26O13/c31-12-6-16(34)23-22(7-12)43-30(11-4-18(36)27(40)19(37)5-11)28(41)25(23)24-17(35)9-21-13(26(24)39)8-20(38)29(42-21)10-1-2-14(32)15(33)3-10/h1-7,9,20,25,28-41H,8H2/t20-,25+,28+,29+,30+/m0/s1 |
| SMILES | OC1=CC2=C(C(O)=C1)[C@H](C1=C(O)C=C3O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)CC3=C1O)[C@@H](O)[C@@H](C1=CC(O)=C(O)C(O)=C1)O2 |
MNX internals
| InChI (mnx) | InChI=1/C30H26O13/c31-12-6-16(34)23-22(7-12)43-30(11-4-18(36)27(40)19(37)5-11)28(41)25(23)24-17(35)9-21-13(26(24)39)8-20(38)29(42-21)10-1-2-14(32)15(33)3-10/h1-7,9,20,25,28-41H,8H2/t20-,25+,28+,29+,30+/m0/s1 |
 |
| SMILES (mnx) | [CH:1]1=[CH:2][C:14]([OH:32])=[C:15]([OH:33])[CH:3]=[C:10]1[C@@H:29]1[C@@H:20]([OH:38])[CH2:8][C:13]2=[C:26]([OH:39])[C:24]([C@H:25]3[C:23]4=[C:16]([OH:34])[CH:6]=[C:12]([OH:31])[CH:7]=[C:22]4[O:43][C@H:30]([C:11]4=[CH:4][C:18]([OH:36])=[C:27]([OH:40])[C:19]([OH:37])=[CH:5]4)[C@@H:28]3[OH:41])=[C:17]([OH:35])[CH:9]=[C:21]2[O:42]1 |
|