| Properties | Image |
|---|
| MNX_ID | MNXM106056 |
 |
| reference | chebi:67480 |
| formula | C32H50O4 |
| global charge | 0 |
| mol weight | 498.748 |
| InChIKey | ZLSDLEGKMGQSFU-BFIHGEENSA-N |
| InChI | InChI=1S/C32H50O4/c1-10-36-30(35)18-20-32(9)26(22(4)5)14-12-24(7)28(32)16-15-27-23(6)11-13-25(21(2)3)31(27,8)19-17-29(33)34/h11,25-28H,2,4,7,10,12-20H2,1,3,5-6,8-9H3,(H,33,34)/t25-,26-,27-,28-,31-,32-/m0/s1 |
| SMILES | C=C(C)[C@@H]1CCC(=C)[C@H](CC[C@H]2C(C)=CC[C@@H](C(=C)C)[C@]2(C)CCC(=O)O)[C@@]1(C)CCC(=O)OCC |
MNX internals
| InChI (mnx) | InChI=1/C32H50O4/c1-10-36-30(35)18-20-32(9)26(22(4)5)14-12-24(7)28(32)16-15-27-23(6)11-13-25(21(2)3)31(27,8)19-17-29(33)34/h11,25-28H,2,4,7,10,12-20H2,1,3,5-6,8-9H3,(H,33,34)/t25-,26-,27-,28-,31-,32-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:10][O:36][C:30]([CH2:18][CH2:20][C@@:32]1([CH3:9])[C@H:26]([C:22](=[CH2:4])[CH3:5])[CH2:14][CH2:12][C:24](=[CH2:7])[C@@H:28]1[CH2:16][CH2:15][C@H:27]1[C:23]([CH3:6])=[CH:11][CH2:13][C@@H:25]([C:21](=[CH2:2])[CH3:3])[C@:31]1([CH3:8])[CH2:19][CH2:17][C:29](=[O:33])[OH:34])=[O:35] |
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