| Properties | Image |
|---|
| MNX_ID | MNXM1193740 |
 |
| reference | envipathM:...4e109721fc45 |
| formula | C37H62O9 |
| global charge | 0 |
| mol weight | 650.894 |
| InChIKey | ZLCMZXNCWJDUOD-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H62O9/c1-3-5-7-9-10-11-12-13-14-15-16-17-19-21-27-34(41)45-30(28-38)29-44-37(43)32(40)25-23-22-24-31(39)35(42)36-33(46-36)26-20-18-8-6-4-2/h9-10,12-13,18,20,28,30-33,35-36,39-40,42H,3-8,11,14-17,19,21-27,29H2,1-2H3 |
| SMILES | CCCCC=CCC=CCCCCCCCC(=O)OC(C=O)COC(=O)C(O)CCCCC(O)C(O)C1OC1CC=CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C37H62O9/c1-3-5-7-9-10-11-12-13-14-15-16-17-19-21-27-34(41)45-30(28-38)29-44-37(43)32(40)25-23-22-24-31(39)35(42)36-33(46-36)26-20-18-8-6-4-2/h9-10,12-13,18,20,28,30-33,35-36,39-40,42H,3-8,11,14-17,19,21-27,29H2,1-2H3/b10-9?,13-12?,20-18?/t30?,31?,32?,33?,35?,36? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:9]=[CH:10][CH2:11][CH:12]=[CH:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:19][CH2:21][CH2:27][C:34](=[O:41])[O:45][CH:30]([CH:28]=[O:38])[CH2:29][O:44][C:37]([CH:32]([CH2:25][CH2:23][CH2:22][CH2:24][CH:31]([CH:35]([CH:36]1[CH:33]([CH2:26][CH:20]=[CH:18][CH2:8][CH2:6][CH2:4][CH3:2])[O:46]1)[OH:42])[OH:39])[OH:40])=[O:43] |
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