| Properties | Image |
|---|
| MNX_ID | MNXM100838 |
 |
| reference | chebi:67702 |
| formula | C35H44O5 |
| global charge | 0 |
| mol weight | 544.732 |
| InChIKey | MXEVRBCQVDKHEV-CFZYZPLLSA-N |
| InChI | InChI=1S/C35H44O5/c1-21(2)38-31-23(5)15-17-27-28(34(27,8)9)19-24(6)33(37)35(20-25(7)32(30(31)35)39-22(3)4)40-29(36)18-16-26-13-11-10-12-14-26/h10-16,18-19,25,27-28,30-32H,1,3,17,20H2,2,4-9H3/b18-16+,23-15-,24-19+/t25-,27-,28+,30-,31-,32-,35+/m0/s1 |
| SMILES | C=C(C)O[C@@H]1[C@@H]2[C@@H](OC(=C)C)/C(C)=C\C[C@H]3[C@@H](/C=C(\C)C(=O)[C@@]2(OC(=O)/C=C/C2=CC=CC=C2)C[C@@H]1C)C3(C)C |
MNX internals
| InChI (mnx) | InChI=1/C35H44O5/c1-21(2)38-31-23(5)15-17-27-28(34(27,8)9)19-24(6)33(37)35(20-25(7)32(30(31)35)39-22(3)4)40-29(36)18-16-26-13-11-10-12-14-26/h10-16,18-19,25,27-28,30-32H,1,3,17,20H2,2,4-9H3/b18-16+,23-15-,24-19+/t25-,27-,28+,30-,31-,32-,35+/m0/s1 |
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| SMILES (mnx) | [CH2:1]=[C:21]([CH3:2])[O:38][C@H:31]1/[C:23]([CH3:5])=[CH:15]\[CH2:17][C@H:27]2[C@@H:28](/[CH:19]=[C:24](\[CH3:6])[C:33](=[O:37])[C@@:35]3([O:40][C:29](/[CH:18]=[CH:16]/[C:26]4=[CH:13][CH:11]=[CH:10][CH:12]=[CH:14]4)=[O:36])[CH2:20][C@H:25]([CH3:7])[C@H:32]([O:39][C:22](=[CH2:3])[CH3:4])[C@H:30]13)[C:34]2([CH3:8])[CH3:9] |
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