| Properties | Image |
|---|
| MNX_ID | MNXM103366 |
 |
| reference | chebi:70268 |
| formula | C27H42O3 |
| global charge | 0 |
| mol weight | 414.63 |
| InChIKey | NOLGXQBEFHYZHI-QPBHWVAKSA-N |
| InChI | InChI=1S/C27H42O3/c1-23(2)19-10-15-26(5)20(24(19,3)13-11-21(23)28)8-7-17-18(9-14-25(17,26)4)27(6)16-12-22(29)30-27/h17-20H,7-16H2,1-6H3/t17-,18+,19+,20-,24+,25-,26-,27+/m1/s1 |
| SMILES | CC1(C)C(=O)CC[C@]2(C)[C@H]3CC[C@@H]4[C@@H]([C@]5(C)CCC(=O)O5)CC[C@@]4(C)[C@]3(C)CC[C@@H]12 |
MNX internals
| InChI (mnx) | InChI=1/C27H42O3/c1-23(2)19-10-15-26(5)20(24(19,3)13-11-21(23)28)8-7-17-18(9-14-25(17,26)4)27(6)16-12-22(29)30-27/h17-20H,7-16H2,1-6H3/t17-,18+,19+,20-,24+,25-,26-,27+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C:23]1([CH3:2])[C@@H:19]2[CH2:10][CH2:15][C@:26]3([CH3:5])[C@H:20]([CH2:8][CH2:7][C@@H:17]4[C@@H:18]([C@:27]5([CH3:6])[CH2:16][CH2:12][C:22](=[O:29])[O:30]5)[CH2:9][CH2:14][C@:25]43[CH3:4])[C@@:24]2([CH3:3])[CH2:13][CH2:11][C:21]1=[O:28] |
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