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hop-22(29)-ene

MNXM4615 is deprecated and here replaced by MNXM736510
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM736510 Image of MNXM736510
referencechebi:4648
formulaC30H50
global charge0
mol weight410.73
InChIKeyHHXYJYBYNZMZKX-PYQRSULMSA-N
InChIInChI=1S/C30H50/c1-20(2)21-12-17-27(5)22(21)13-18-29(7)24(27)10-11-25-28(6)16-9-15-26(3,4)23(28)14-19-30(25,29)8/h21-25H,1,9-19H2,2-8H3/t21-,22+,23+,24-,25-,27+,28+,29-,30-/m1/s1
SMILESC=C(C)[C@H]1CC[C@]2(C)[C@H]3CC[C@@H]4[C@@]5(C)CCCC(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@H]12
MNX internals
InChI (mnx)InChI=1/C30H50/c1-20(2)21-12-17-27(5)22(21)13-18-29(7)24(27)10-11-25-28(6)16-9-15-26(3,4)23(28)14-19-30(25,29)8/h21-25H,1,9-19H2,2-8H3/t21-,22+,23+,24-,25-,27+,28+,29-,30-/m1/s1 Image of MNXM736510
SMILES (mnx)[CH2:1]=[C:20]([CH3:2])[C@H:21]1[CH2:12][CH2:17][C@@:27]2([CH3:5])[C@H:22]1[CH2:13][CH2:18][C@:29]1([CH3:7])[C@@H:24]2[CH2:10][CH2:11][C@@H:25]2[C@@:28]3([CH3:6])[CH2:16][CH2:9][CH2:15][C:26]([CH3:3])([CH3:4])[C@@H:23]3[CH2:14][CH2:19][C@:30]21[CH3:8]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:4648
chebi:4648
HHXYJYBYNZMZKX-PYQRSULMSA-N 		hop-22(29)-ene
22(29)-Hopene
A'-neogammacer-22(29)-ene
Diploptene
Hop-22(29)-ene

sabiork.compound:8530
sabiorkM:8530
kegg.compound:C06310
keggC:C06310
HHXYJYBYNZMZKX-PYQRSULMSA-N 		Diploptene
22(29)-Hopene
Hop-22(29)-ene

seed.compound:cpd03751
seedM:cpd03751
HHXYJYBYNZMZKX-PYQRSULMSA-N 		Diploptene
22(29)-Hopene
Hop-22(29)-ene
diploptene
hop-22(29)-ene

lipidmaps:LMPR04000001
lipidmapsM:LMPR04000001
HHXYJYBYNZMZKX-PYQRSULMSA-N 		Diploptene
Hop-22(29)-ene
Hopene

metacyc.compound:HOP-2229-ENE
metacycM:HOP-2229-ENE
HHXYJYBYNZMZKX-PYQRSULMSA-N 		hop-22(29)-ene
diploptene

keggC:M_C06310
seedM:M_cpd03751 		secondary/obsolete/fantasy identifier