| Properties | Image |
|---|
| MNX_ID | MNXM1129912 |
 |
| reference | chebi:178028 |
| formula | C30H43O4 |
| global charge | -1 |
| mol weight | 467.67 |
| InChIKey | SNZQBBATMLGADX-UXRQJHJJSA-M |
| InChI | InChI=1S/C30H44O4/c1-18(9-8-10-19(2)26(33)34)22-17-25(32)30(7)21-11-12-23-27(3,4)24(31)14-15-28(23,5)20(21)13-16-29(22,30)6/h10-11,13,18,22-23,25,32H,8-9,12,14-17H2,1-7H3,(H,33,34)/p-1/b19-10+/t18-,22-,23?,25+,28-,29-,30-/m1/s1 |
| SMILES | C/C(=C\CC[C@@H](C)[C@H]1C[C@H](O)[C@@]2(C)C3=CCC4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C)C(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C30H44O4/c1-18(9-8-10-19(2)26(33)34)22-17-25(32)30(7)21-11-12-23-27(3,4)24(31)14-15-28(23,5)20(21)13-16-29(22,30)6/h10-11,13,18,22-23,25,32H,8-9,12,14-17H2,1-7H3,(H,33,34)/b19-10+/t18-,22-,23?,25+,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:22]1[CH2:17][C@H:25]([OH:32])[C@@:30]2([CH3:7])[C:21]3=[CH:11][CH2:12][CH:23]4[C:27]([CH3:3])([CH3:4])[C:24](=[O:31])[CH2:14][CH2:15][C@:28]4([CH3:5])[C:20]3=[CH:13][CH2:16][C@:29]12[CH3:6] |
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