| Properties | Image |
|---|
| MNX_ID | MNXM147685 |
 |
| reference | metacycM:CPD-16620 |
| formula | C30H50O2 |
| global charge | 0 |
| mol weight | 442.728 |
| InChIKey | FEICVHTUVUPNSC-BSSSUIKASA-N |
| InChI | InChI=1S/C30H50O2/c1-24(2)13-14-26(5)15-16-29(8)28(7)12-9-19-25(3,4)22(31)10-11-27(19,6)20(28)17-23-30(29,32-23)21(26)18-24/h19-23,31H,9-18H2,1-8H3/t19-,20+,21+,22-,23+,26+,27-,28+,29-,30+/m0/s1 |
| SMILES | CC1(C)CC[C@]2(C)CC[C@]3(C)[C@@]4(O[C@@H]4C[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1 |
MNX internals
| InChI (mnx) | InChI=1/C30H50O2/c1-24(2)13-14-26(5)15-16-29(8)28(7)12-9-19-25(3,4)22(31)10-11-27(19,6)20(28)17-23-30(29,32-23)21(26)18-24/h19-23,31H,9-18H2,1-8H3/t19-,20+,21+,22-,23+,26+,27-,28+,29-,30+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:24]1([CH3:2])[CH2:13][CH2:14][C@:26]2([CH3:5])[CH2:15][CH2:16][C@@:29]3([CH3:8])[C@:28]4([CH3:7])[CH2:12][CH2:9][C@H:19]5[C:25]([CH3:3])([CH3:4])[C@@H:22]([OH:31])[CH2:10][CH2:11][C@:27]5([CH3:6])[C@H:20]4[CH2:17][C@@H:23]4[C@@:30]3([C@@H:21]2[CH2:18]1)[O:32]4 |
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