| Properties | Image |
|---|
| MNX_ID | MNXM106080 |
 |
| reference | chebi:66554 |
| formula | C30H38O2 |
| global charge | 0 |
| mol weight | 430.632 |
| InChIKey | XNIZFYLMUVNEOT-MUVIMXQCSA-N |
| InChI | InChI=1S/C30H38O2/c1-17-11-25(31)23(27(3)9-7-19-15-29(19,27)5)13-21(17)22-14-24(26(32)12-18(22)2)28(4)10-8-20-16-30(20,28)6/h11-14,19-20,31-32H,7-10,15-16H2,1-6H3/t19-,20-,27+,28+,29+,30+/m1/s1 |
| SMILES | CC1=CC(O)=C([C@]2(C)CC[C@@H]3C[C@@]32C)C=C1C1=CC([C@]2(C)CC[C@@H]3C[C@@]32C)=C(O)C=C1C |
MNX internals
| InChI (mnx) | InChI=1/C30H38O2/c1-17-11-25(31)23(27(3)9-7-19-15-29(19,27)5)13-21(17)22-14-24(26(32)12-18(22)2)28(4)10-8-20-16-30(20,28)6/h11-14,19-20,31-32H,7-10,15-16H2,1-6H3/t19-,20-,27+,28+,29+,30+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C:17]1=[CH:11][C:25]([OH:31])=[C:23]([C@:27]2([CH3:3])[CH2:9][CH2:7][C@@H:19]3[CH2:15][C@@:29]32[CH3:5])[CH:13]=[C:21]1[C:22]1=[CH:14][C:24]([C@:28]2([CH3:4])[CH2:10][CH2:8][C@@H:20]3[CH2:16][C@@:30]32[CH3:6])=[C:26]([OH:32])[CH:12]=[C:18]1[CH3:2] |
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