| Properties | Image |
|---|
| MNX_ID | MNXM104807 |
 |
| reference | chebi:70463 |
| formula | C30H50O4 |
| global charge | 0 |
| mol weight | 474.726 |
| InChIKey | ZKBGKWZSOPPDSD-ZFQFSHTNSA-N |
| InChI | InChI=1S/C30H50O4/c1-19(2)20-11-17-29(7)23(27(20,5)15-14-25(31)32)10-9-21-22(12-16-28(21,29)6)30(8)18-13-24(34-30)26(3,4)33/h20-24,33H,1,9-18H2,2-8H3,(H,31,32)/t20-,21+,22-,23+,24-,27-,28+,29+,30-/m0/s1 |
| SMILES | C=C(C)[C@@H]1CC[C@]2(C)[C@H](CC[C@@H]3[C@@H]([C@]4(C)CC[C@@H](C(C)(C)O)O4)CC[C@]32C)[C@@]1(C)CCC(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C30H50O4/c1-19(2)20-11-17-29(7)23(27(20,5)15-14-25(31)32)10-9-21-22(12-16-28(21,29)6)30(8)18-13-24(34-30)26(3,4)33/h20-24,33H,1,9-18H2,2-8H3,(H,31,32)/t20-,21+,22-,23+,24-,27-,28+,29+,30-/m0/s1 |
 |
| SMILES (mnx) | [CH2:1]=[C:19]([CH3:2])[C@@H:20]1[CH2:11][CH2:17][C@:29]2([CH3:7])[C@H:23]([CH2:10][CH2:9][C@@H:21]3[C@@H:22]([C@:30]4([CH3:8])[CH2:18][CH2:13][C@@H:24]([C:26]([CH3:3])([CH3:4])[OH:33])[O:34]4)[CH2:12][CH2:16][C@:28]32[CH3:6])[C@@:27]1([CH3:5])[CH2:15][CH2:14][C:25](=[O:31])[OH:32] |
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