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stemod-13(17)-ene

PropertiesImage
MNX_IDMNXM4830 Image of MNXM4830
referencechebi:50068
formulaC20H32
global charge0
mol weight272.476
InChIKeyGNNRCBBKCVNPSC-VDWQKOAOSA-N
InChIInChI=1S/C20H32/c1-14-8-11-20-13-15(14)12-16(20)6-7-17-18(2,3)9-5-10-19(17,20)4/h15-17H,1,5-13H2,2-4H3/t15-,16-,17-,19-,20+/m0/s1
SMILESC=C1CC[C@@]23C[C@@H]1C[C@@H]2CC[C@H]1C(C)(C)CCC[C@@]13C
MNX internals
InChI (mnx)InChI=1/C20H32/c1-14-8-11-20-13-15(14)12-16(20)6-7-17-18(2,3)9-5-10-19(17,20)4/h15-17H,1,5-13H2,2-4H3/t15-,16-,17-,19-,20+/m0/s1 Image of MNXM4830
SMILES (mnx)[CH2:1]=[C:14]1[CH2:8][CH2:11][C@@:20]23[CH2:13][C@@H:15]1[CH2:12][C@@H:16]2[CH2:6][CH2:7][C@H:17]1[C:18]([CH3:2])([CH3:3])[CH2:9][CH2:5][CH2:10][C@@:19]13[CH3:4]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)7
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:50068
chebi:50068
lipidmaps:LMPR0104030007
lipidmapsM:LMPR0104030007
GNNRCBBKCVNPSC-VDWQKOAOSA-N 		stemod-13(17)-ene
(4aS,6aS,8S,11aR,11bS)-4,4,11b-trimethyl-9-methylenetetradecahydro-8,11a-methanocyclohepta[a]naphthalene
(4aS,6aS,8S,11aR,11bS)-4,4,11b-trimethyl-9-methylidenetetradecahydro-8,11a-methanocyclohepta[a]naphthalene

metacyc.compound:CPD-9907
metacycM:CPD-9907
GNNRCBBKCVNPSC-VDWQKOAOSA-N 		9beta-stemod-13(17)-ene
exo-stemodene
stemod-13(17)-ene
syn-stemod-13(17)-ene
syn-stemodene

kegg.compound:C18224
keggC:C18224
GNNRCBBKCVNPSC-VDWQKOAOSA-N 		Stemod-13(17)-ene

seed.compound:cpd19492
seedM:cpd19492
GNNRCBBKCVNPSC-VDWQKOAOSA-N 		Stemod-13(17)-ene
9beta-stemod-13(17)-ene
exo-stemodene
stemod-13(17)-ene
syn-stemod-13(17)-ene
syn-stemodene

keggC:M_C18224
seedM:M_cpd19492 		secondary/obsolete/fantasy identifier