| Properties | Image |
|---|
| MNX_ID | MNXM101719 |
 |
| reference | chebi:67950 |
| formula | C30H48O5 |
| global charge | 0 |
| mol weight | 488.709 |
| InChIKey | JXSVIVRDWWRQRT-SVOQGVCWSA-N |
| InChI | InChI=1S/C30H48O5/c1-17-9-12-30(25(34)35)14-13-28(5)19(23(30)18(17)2)7-8-22-26(3)15-20(32)24(33)27(4,16-31)21(26)10-11-29(22,28)6/h7,17-18,20-24,31-33H,8-16H2,1-6H3,(H,34,35)/t17-,18+,20-,21-,22-,23+,24-,26+,27+,28-,29-,30+/m1/s1 |
| SMILES | C[C@H]1[C@H](C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@H]12 |
MNX internals
| InChI (mnx) | InChI=1/C30H48O5/c1-17-9-12-30(25(34)35)14-13-28(5)19(23(30)18(17)2)7-8-22-26(3)15-20(32)24(33)27(4,16-31)21(26)10-11-29(22,28)6/h7,17-18,20-24,31-33H,8-16H2,1-6H3,(H,34,35)/t17-,18+,20-,21-,22-,23+,24-,26+,27+,28-,29-,30+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C@@H:17]1[CH2:9][CH2:12][C@:30]2([C:25](=[O:34])[OH:35])[CH2:14][CH2:13][C@:28]3([CH3:5])[C:19](=[CH:7][CH2:8][C@@H:22]4[C@@:26]5([CH3:3])[CH2:15][C@@H:20]([OH:32])[C@@H:24]([OH:33])[C@@:27]([CH3:4])([CH2:16][OH:31])[C@@H:21]5[CH2:10][CH2:11][C@:29]43[CH3:6])[C@@H:23]2[C@H:18]1[CH3:2] |
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