| Properties | Image |
|---|
| MNX_ID | MNXM106534 |
 |
| reference | chebi:70523 |
| formula | C30H44O5 |
| global charge | 0 |
| mol weight | 484.677 |
| InChIKey | HASDXLPYERWHOW-STBDDEOLSA-N |
| InChI | InChI=1S/C30H44O5/c1-17(2)21(35-33)10-8-18-25-22(34-26(18)32)16-30(7)20-9-11-23-27(3,4)24(31)13-14-28(23,5)19(20)12-15-29(25,30)6/h9,18-19,21-23,25,33H,1,8,10-16H2,2-7H3/t18-,19+,21-,22+,23+,25-,28-,29+,30-/m1/s1 |
| SMILES | C=C(C)[C@@H](CC[C@H]1C(=O)O[C@H]2C[C@]3(C)C4=CC[C@H]5C(C)(C)C(=O)CC[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]21)OO |
MNX internals
| InChI (mnx) | InChI=1/C30H44O5/c1-17(2)21(35-33)10-8-18-25-22(34-26(18)32)16-30(7)20-9-11-23-27(3,4)24(31)13-14-28(23,5)19(20)12-15-29(25,30)6/h9,18-19,21-23,25,33H,1,8,10-16H2,2-7H3/t18-,19+,21-,22+,23+,25-,28-,29+,30-/m1/s1 |
 |
| SMILES (mnx) | [CH2:1]=[C:17]([CH3:2])[C@@H:21]([CH2:10][CH2:8][C@@H:18]1[C@@H:25]2[C@H:22]([CH2:16][C@:30]3([CH3:7])[C:20]4=[CH:9][CH2:11][C@H:23]5[C:27]([CH3:3])([CH3:4])[C:24](=[O:31])[CH2:13][CH2:14][C@:28]5([CH3:5])[C@H:19]4[CH2:12][CH2:15][C@@:29]23[CH3:6])[O:34][C:26]1=[O:32])[O:35][OH:33] |
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