| Properties | Image |
|---|
| MNX_ID | MNXM1555679 |
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| reference | hmdb:HMDB0303742 |
| formula | C46H80O2 |
| global charge | 0 |
| mol weight | 665.144 |
| InChIKey | BWXDHBQGBNPJMN-UHFFFAOYSA-N |
| InChI | InChI=1S/C46H80O2/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-40(47)48-39-28-30-44(7)37(42(39,4)5)27-31-46(9)38(44)25-24-36-41-35(34(2)3)26-29-43(41,6)32-33-45(36,46)8/h35-39,41H,2,10-33H2,1,3-9H3 |
| SMILES | C=C(C)C1CCC2(C)CCC3(C)C(CCC4C5(C)CCC(OC(=O)CCCCCCCCCCCCCCC)C(C)(C)C5CCC43C)C12 |
MNX internals
| InChI (mnx) | InChI=1/C46H80O2/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-40(47)48-39-28-30-44(7)37(42(39,4)5)27-31-46(9)38(44)25-24-36-41-35(34(2)3)26-29-43(41,6)32-33-45(36,46)8/h35-39,41H,2,10-33H2,1,3-9H3/t35?,36?,37?,38?,39?,41?,43?,44?,45?,46? |
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| SMILES (mnx) | [CH3:1][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][C:40](=[O:47])[O:48][CH:39]1[CH2:28][CH2:30][C:44]2([CH3:7])[CH:37]([CH2:27][CH2:31][C:46]3([CH3:9])[CH:38]2[CH2:25][CH2:24][CH:36]2[CH:41]4[CH:35]([C:34](=[CH2:2])[CH3:3])[CH2:26][CH2:29][C:43]4([CH3:6])[CH2:32][CH2:33][C:45]23[CH3:8])[C:42]1([CH3:4])[CH3:5] |
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