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dammara-20,24-diene

PropertiesImage
MNX_IDMNXM5706 Image of MNXM5706
referencechebi:62447
formulaC30H50
global charge0
mol weight410.73
InChIKeySEXOMBPXHYAKHY-YCJSVCQFSA-N
InChIInChI=1S/C30H50/c1-21(2)11-9-12-22(3)23-15-19-29(7)24(23)13-14-26-28(6)18-10-17-27(4,5)25(28)16-20-30(26,29)8/h11,23-26H,3,9-10,12-20H2,1-2,4-8H3/t23-,24-,25+,26-,28+,29-,30-/m1/s1
SMILESC=C(CCC=C(C)C)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CCCC(C)(C)[C@@H]3CC[C@]12C
MNX internals
InChI (mnx)InChI=1/C30H50/c1-21(2)11-9-12-22(3)23-15-19-29(7)24(23)13-14-26-28(6)18-10-17-27(4,5)25(28)16-20-30(26,29)8/h11,23-26H,3,9-10,12-20H2,1-2,4-8H3/t23-,24-,25+,26-,28+,29-,30-/m1/s1 Image of MNXM5706
SMILES (mnx)[C@:1]12([CH3:14])[C@:2]3([CH3:13])[C@@H:5]([CH2:9][CH2:8][C@H:4]1[C@:3]1([CH3:15])[C@H:6]([CH2:10][CH2:7]2)[C:11]([CH3:18])([CH3:19])[CH2:16][CH2:17][CH2:12]1)[C@H:20]([C:23]([CH2:25][CH2:24]/[CH:27]=[C:28](\[CH3:29])[CH3:30])=[CH2:26])[CH2:21][CH2:22]3
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:62447
chebi:62447
SEXOMBPXHYAKHY-YCJSVCQFSA-N
dammara-20,24-diene
dammara-18(28),21-diene

kegg.compound:C19834
keggC:C19834
SEXOMBPXHYAKHY-YCJSVCQFSA-N
Dammara-20,24-diene
Dammara-18(28),21-diene

seed.compound:cpd21076
seedM:cpd21076
SEXOMBPXHYAKHY-YCJSVCQFSA-N
Dammara-20,24-diene
Dammara-18(28),21-diene
dammara-18(28),21-diene
dammara-20,24-dien

lipidmaps:LMPR0106080022
lipidmapsM:LMPR0106080022
SEXOMBPXHYAKHY-YCJSVCQFSA-N
dammara-20,24-diene
dammara-20,24-diene

metacyc.compound:CPD-10642
metacycM:CPD-10642
SEXOMBPXHYAKHY-YCJSVCQFSA-N
dammara-20,24-dien
dammara-18(28),21-diene

keggC:M_C19834
seedM:M_cpd21076
secondary/obsolete/fantasy identifier