| Properties | Image |
|---|
| MNX_ID | MNXM107246 |
 |
| reference | chebi:66626 |
| formula | C30H46O4 |
| global charge | 0 |
| mol weight | 470.694 |
| InChIKey | NJFOSFIPGRXARF-BRTULJEKSA-N |
| InChI | InChI=1S/C30H46O4/c1-19(2)22-10-11-24-28(6)14-12-23(20(3)8-7-9-21(4)26(33)34)27(28,5)16-17-30(24)18-29(22,30)15-13-25(31)32/h9,20,22-24H,1,7-8,10-18H2,2-6H3,(H,31,32)(H,33,34)/b21-9-/t20-,22+,23-,24+,27-,28+,29-,30+/m1/s1 |
| SMILES | C=C(C)[C@@H]1CC[C@@H]2[C@]3(CC[C@]4(C)[C@@H]([C@H](C)CC/C=C(/C)C(=O)O)CC[C@@]24C)C[C@]13CCC(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C30H46O4/c1-19(2)22-10-11-24-28(6)14-12-23(20(3)8-7-9-21(4)26(33)34)27(28,5)16-17-30(24)18-29(22,30)15-13-25(31)32/h9,20,22-24H,1,7-8,10-18H2,2-6H3,(H,31,32)(H,33,34)/b21-9-/t20-,22+,23-,24+,27-,28+,29-,30+/m1/s1 |
 |
| SMILES (mnx) | [CH2:1]=[C:19]([CH3:2])[C@@H:22]1[CH2:10][CH2:11][C@H:24]2[C@:28]3([CH3:6])[CH2:14][CH2:12][C@H:23]([C@H:20]([CH3:3])[CH2:8][CH2:7]/[CH:9]=[C:21](/[CH3:4])[C:26](=[O:33])[OH:34])[C@@:27]3([CH3:5])[CH2:16][CH2:17][C@:30]23[CH2:18][C@:29]13[CH2:15][CH2:13][C:25](=[O:31])[OH:32] |
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