| Properties | Image |
|---|
| MNX_ID | MNXM1173209 |
 |
| reference | envipathM:...92a0c6594d41 |
| formula | C27H46O3 |
| global charge | 0 |
| mol weight | 418.662 |
| InChIKey | UWHRHVJUNURSHC-UHFFFAOYSA-N |
| InChI | InChI=1S/C27H46O3/c1-16(2)7-6-8-17(3)20-9-10-21-25-22(11-12-26(20,21)4)27(5)18(14-23(25)29)13-19(28)15-24(27)30/h14,16-17,19-25,28-30H,6-13,15H2,1-5H3 |
| SMILES | CC(C)CCCC(C)C1CCC2C3C(O)C=C4CC(O)CC(O)C4(C)C3CCC12C |
MNX internals
| InChI (mnx) | InChI=1/C27H46O3/c1-16(2)7-6-8-17(3)20-9-10-21-25-22(11-12-26(20,21)4)27(5)18(14-23(25)29)13-19(28)15-24(27)30/h14,16-17,19-25,28-30H,6-13,15H2,1-5H3/t17?,19?,20?,21?,22?,23?,24?,25?,26?,27? |
 |
| SMILES (mnx) | [CH3:1][CH:16]([CH3:2])[CH2:7][CH2:6][CH2:8][CH:17]([CH3:3])[CH:20]1[CH2:9][CH2:10][CH:21]2[CH:25]3[CH:22]([CH2:11][CH2:12][C:26]12[CH3:4])[C:27]1([CH3:5])[C:18](=[CH:14][CH:23]3[OH:29])[CH2:13][CH:19]([OH:28])[CH2:15][CH:24]1[OH:30] |
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