| Properties | Image |
|---|
| MNX_ID | MNXM57725 |
 |
| reference | chebi:138823 |
| formula | C29H46O7 |
| global charge | 0 |
| mol weight | 506.68 |
| InChIKey | LZLQZSMXUGFMJF-OMEQKXGASA-N |
| InChI | InChI=1S/C29H46O7/c1-18-14-24-11-8-12-25(31)22(5)20(3)16-27(32)35-26(15-21(4)23(6)30)19(2)10-9-13-28(7,33)29(34,17-18)36-24/h8-9,12-13,16,19,21-26,30-31,33-34H,1,10-11,14-15,17H2,2-7H3/b12-8+,13-9+,20-16-/t19-,21-,22+,23-,24-,25-,26+,28+,29-/m0/s1 |
| SMILES | C=C1C[C@@H]2C/C=C/[C@H](O)[C@H](C)/C(C)=C\C(=O)O[C@H](C[C@H](C)[C@H](C)O)[C@@H](C)C/C=C/[C@@](C)(O)[C@](O)(C1)O2 |
MNX internals
| InChI (mnx) | InChI=1/C29H46O7/c1-18-14-24-11-8-12-25(31)22(5)20(3)16-27(32)35-26(15-21(4)23(6)30)19(2)10-9-13-28(7,33)29(34,17-18)36-24/h8-9,12-13,16,19,21-26,30-31,33-34H,1,10-11,14-15,17H2,2-7H3/b12-8+,13-9+,20-16-/t19-,21-,22+,23-,24-,25-,26+,28+,29-/m0/s1 |
 |
| SMILES (mnx) | [CH2:1]=[C:18]1[CH2:14][C@@H:24]2[CH2:11]/[CH:8]=[CH:12]/[C@H:25]([OH:31])[C@H:22]([CH3:5])/[C:20]([CH3:3])=[CH:16]\[C:27](=[O:32])[O:35][C@H:26]([CH2:15][C@H:21]([CH3:4])[C@H:23]([CH3:6])[OH:30])[C@@H:19]([CH3:2])[CH2:10]/[CH:9]=[CH:13]/[C@@:28]([CH3:7])([OH:33])[C@:29]([OH:34])([CH2:17]1)[O:36]2 |
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