| Properties | Image |
|---|
| MNX_ID | MNXM120618 |
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| reference | hmdb:HMDB0032732 |
| formula | C35H64O5 |
| global charge | 0 |
| mol weight | 564.892 |
| InChIKey | RBSBTRALZZSVBA-UHFFFAOYSA-N |
| InChI | InChI=1S/C35H64O5/c1-3-4-5-6-7-8-12-15-18-21-24-31(36)33-26-27-34(40-33)32(37)25-22-19-16-13-10-9-11-14-17-20-23-30-28-29(2)39-35(30)38/h28-29,31-34,36-37H,3-27H2,1-2H3 |
| SMILES | CCCCCCCCCCCCC(O)C1CCC(C(O)CCCCCCCCCCCCC2=CC(C)OC2=O)O1 |
MNX internals
| InChI (mnx) | InChI=1/C35H64O5/c1-3-4-5-6-7-8-12-15-18-21-24-31(36)33-26-27-34(40-33)32(37)25-22-19-16-13-10-9-11-14-17-20-23-30-28-29(2)39-35(30)38/h28-29,31-34,36-37H,3-27H2,1-2H3/t29?,31?,32?,33?,34? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:12][CH2:15][CH2:18][CH2:21][CH2:24][CH:31]([CH:33]1[CH2:26][CH2:27][CH:34]([CH:32]([CH2:25][CH2:22][CH2:19][CH2:16][CH2:13][CH2:10][CH2:9][CH2:11][CH2:14][CH2:17][CH2:20][CH2:23][C:30]2=[CH:28][CH:29]([CH3:2])[O:39][C:35]2=[O:38])[OH:37])[O:40]1)[OH:36] |
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