| Properties | Image |
|---|
| MNX_ID | MNXM738582 |
 |
| reference | keggC:C03428 |
| formula | C30H52O7P2 |
| global charge | 0 |
| mol weight | 586.687 |
| InChIKey | ATZKAUGGNMSCCY-VVFNRDJMSA-N |
| InChI | InChI=1S/C30H52O7P2/c1-23(2)13-9-15-25(5)17-11-18-27(7)21-28-29(22-36-39(34,35)37-38(31,32)33)30(28,8)20-12-19-26(6)16-10-14-24(3)4/h13-14,17,19,21,28-29H,9-12,15-16,18,20,22H2,1-8H3,(H,34,35)(H2,31,32,33)/b25-17+,26-19+,27-21+/t28-,29-,30-/m1/s1 |
| SMILES | CC(C)=CCC/C(C)=C/CC/C(C)=C/[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)[C@]1(C)CC/C=C(\C)CCC=C(C)C |
MNX internals
| InChI (mnx) | InChI=1/C30H52O7P2/c1-23(2)13-9-15-25(5)17-11-18-27(7)21-28-29(22-36-39(34,35)37-38(31,32)33)30(28,8)20-12-19-26(6)16-10-14-24(3)4/h13-14,17,19,21,28-29H,9-12,15-16,18,20,22H2,1-8H3,(H,34,35)(H2,31,32,33)/b25-17+,26-19+,27-21+/t28-,29-,30-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C:23]([CH3:2])=[CH:13][CH2:9][CH2:15]/[C:25]([CH3:5])=[CH:17]/[CH2:11][CH2:18]/[C:27]([CH3:7])=[CH:21]/[C@@H:28]1[C@@H:29]([CH2:22][O:36][P:39]([OH:34])(=[O:35])[O:37][P:38]([OH:31])([OH:32])=[O:33])[C@:30]1([CH3:8])[CH2:20][CH2:12]/[CH:19]=[C:26](\[CH3:6])[CH2:16][CH2:10][CH:14]=[C:24]([CH3:3])[CH3:4] |
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