| Properties | Image |
|---|
| MNX_ID | MNXM101907 |
 |
| reference | chebi:69632 |
| formula | C30H52O4 |
| global charge | 0 |
| mol weight | 476.742 |
| InChIKey | OBINFOUDXKPAJN-PUPUOACPSA-N |
| InChI | InChI=1S/C30H52O4/c1-25(2)21-16-24(33)30(8)20(28(21,6)14-12-22(25)31)10-9-19-27(5)13-11-17(26(3,4)34)18(27)15-23(32)29(19,30)7/h17-24,31-34H,9-16H2,1-8H3/t17-,18-,19+,20+,21-,22-,23-,24-,27-,28+,29-,30-/m0/s1 |
| SMILES | CC(C)(O)[C@H]1CC[C@]2(C)[C@H]3CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5C[C@H](O)[C@@]4(C)[C@]3(C)[C@@H](O)C[C@@H]12 |
MNX internals
| InChI (mnx) | InChI=1/C30H52O4/c1-25(2)21-16-24(33)30(8)20(28(21,6)14-12-22(25)31)10-9-19-27(5)13-11-17(26(3,4)34)18(27)15-23(32)29(19,30)7/h17-24,31-34H,9-16H2,1-8H3/t17-,18-,19+,20+,21-,22-,23-,24-,27-,28+,29-,30-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:25]1([CH3:2])[C@@H:21]2[CH2:16][C@H:24]([OH:33])[C@:30]3([CH3:8])[C@H:20]([CH2:10][CH2:9][C@@H:19]4[C@@:27]5([CH3:5])[CH2:13][CH2:11][C@H:17]([C:26]([CH3:3])([CH3:4])[OH:34])[C@@H:18]5[CH2:15][C@H:23]([OH:32])[C@:29]43[CH3:7])[C@@:28]2([CH3:6])[CH2:14][CH2:12][C@@H:22]1[OH:31] |
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