| Properties | Image |
|---|
| MNX_ID | MNXM1129910 |
 |
| reference | chebi:178026 |
| formula | C30H43O4 |
| global charge | -1 |
| mol weight | 467.67 |
| InChIKey | ZTKZZRIVAYGFSF-LYWQSRDLSA-M |
| InChI | InChI=1S/C30H44O4/c1-18(9-8-10-19(2)26(33)34)20-11-16-30(7)25-21(12-15-29(20,30)6)28(5)14-13-24(32)27(3,4)23(28)17-22(25)31/h10,18,20,23H,8-9,11-17H2,1-7H3,(H,33,34)/p-1/b19-10+/t18-,20-,23?,28-,29-,30+/m1/s1 |
| SMILES | C/C(=C\CC[C@@H](C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1CC3=O)C(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C30H44O4/c1-18(9-8-10-19(2)26(33)34)20-11-16-30(7)25-21(12-15-29(20,30)6)28(5)14-13-24(32)27(3,4)23(28)17-22(25)31/h10,18,20,23H,8-9,11-17H2,1-7H3,(H,33,34)/b19-10+/t18-,20-,23?,28-,29-,30+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C@H:18]([CH2:9][CH2:8]/[CH:10]=[C:19](\[CH3:2])[C:26](=[O:33])[OH:34])[C@H:20]1[CH2:11][CH2:16][C@@:30]2([CH3:7])[C:25]3=[C:21]([CH2:12][CH2:15][C@:29]12[CH3:6])[C@@:28]1([CH3:5])[CH2:14][CH2:13][C:24](=[O:32])[C:27]([CH3:3])([CH3:4])[CH:23]1[CH2:17][C:22]3=[O:31] |
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