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stemod-13(17)-ene

Properties

Image

Occurences in reactions

MNX_ID

MNXM4830

	#reac
in my sandbox	0
in MNXref (generic)	8
in models (compartimentalized)	0

formula

C₂₀H₃₂

charge

mass

272.476

reference

chebi:50068

InChIKey

GNNRCBBKCVNPSC-VDWQKOAOSA-N

InChI

InChI=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

SMILES

[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]

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Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:50068 chebi:50068 lipidmaps:LMPR0104030007 lipidmapsM:LMPR0104030007	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	9beta-stemod-13(17)-ene exo-stemodene stemod-13(17)-ene syn-stemod-13(17)-ene syn-stemodene
kegg.compound:C18224 keggC:C18224	Stemod-13(17)-ene
seed.compound:cpd19492 seedM:cpd19492	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