| Properties | Image |
|---|
| MNX_ID | MNXM89471 |
 |
| reference | chebi:52389 |
| formula | C29H46O2 |
| global charge | 0 |
| mol weight | 426.685 |
| InChIKey | GGLAWNOISZYLHT-FICDAWEZSA-N |
| InChI | InChI=1S/C29H46O2/c1-18(2)8-7-9-19(3)22-12-13-23-21-10-11-25-27(20(4)30)26(31)15-17-29(25,6)24(21)14-16-28(22,23)5/h8,19,22-23,25-27,31H,7,9-17H2,1-6H3/t19-,22-,23+,25+,26+,27?,28-,29-/m1/s1 |
| SMILES | CC(=O)C1[C@@H](O)CC[C@]2(C)C3=C(CC[C@@H]12)[C@@H]1CC[C@H]([C@H](C)CCC=C(C)C)[C@@]1(C)CC3 |
MNX internals
| InChI (mnx) | InChI=1/C29H46O2/c1-18(2)8-7-9-19(3)22-12-13-23-21-10-11-25-27(20(4)30)26(31)15-17-29(25,6)24(21)14-16-28(22,23)5/h8,19,22-23,25-27,31H,7,9-17H2,1-6H3/t19-,22-,23+,25+,26+,27?,28-,29-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C:18]([CH3:2])=[CH:8][CH2:7][CH2:9][C@@H:19]([CH3:3])[C@H:22]1[CH2:12][CH2:13][C@H:23]2[C:21]3=[C:24]([CH2:14][CH2:16][C@:28]12[CH3:5])[C@@:29]1([CH3:6])[CH2:17][CH2:15][C@H:26]([OH:31])[CH:27]([C:20]([CH3:4])=[O:30])[C@@H:25]1[CH2:11][CH2:10]3 |
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