| Properties | Image |
|---|
| MNX_ID | MNXM19476 |
 |
| reference | metacycM:CPD-13049 |
| formula | C30H50O |
| global charge | 0 |
| mol weight | 426.729 |
| InChIKey | ZDFUASMRJUVZJP-GIIHIBIBSA-N |
| InChI | InChI=1S/C30H50O/c1-25(2)15-16-27(5)17-18-29(7)21-9-10-22-26(3,4)24(31)12-13-28(22,6)20(21)11-14-30(29,8)23(27)19-25/h9,20,22-24,31H,10-19H2,1-8H3/t20-,22-,23+,24-,27+,28+,29+,30-/m0/s1 |
| SMILES | CC1(C)CC[C@]2(C)CC[C@]3(C)C4=CC[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]2C1 |
MNX internals
| InChI (mnx) | InChI=1/C30H50O/c1-25(2)15-16-27(5)17-18-29(7)21-9-10-22-26(3,4)24(31)12-13-28(22,6)20(21)11-14-30(29,8)23(27)19-25/h9,20,22-24,31H,10-19H2,1-8H3/t20-,22-,23+,24-,27+,28+,29+,30-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:25]1([CH3:2])[CH2:15][CH2:16][C@:27]2([CH3:5])[CH2:17][CH2:18][C@:29]3([CH3:7])[C:21]4=[CH:9][CH2:10][C@H:22]5[C:26]([CH3:3])([CH3:4])[C@@H:24]([OH:31])[CH2:12][CH2:13][C@:28]5([CH3:6])[C@H:20]4[CH2:11][CH2:14][C@@:30]3([CH3:8])[C@@H:23]2[CH2:19]1 |
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