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3-deoxycapsidiol

PropertiesImage
MNX_IDMNXM10002 Image of MNXM10002
referencechebi:72642
formulaC15H24O
global charge0
mol weight220.356
InChIKeyNJWPLFBOSCSZFA-QHSBEEBCSA-N
InChIInChI=1S/C15H24O/c1-10(2)12-6-7-13-14(16)8-5-11(3)15(13,4)9-12/h7,11-12,14,16H,1,5-6,8-9H2,2-4H3/t11-,12-,14-,15-/m1/s1
SMILESC=C(C)[C@@H]1CC=C2[C@H](O)CC[C@@H](C)[C@@]2(C)C1
MNX internals
InChI (mnx)InChI=1/C15H24O/c1-10(2)12-6-7-13-14(16)8-5-11(3)15(13,4)9-12/h7,11-12,14,16H,1,5-6,8-9H2,2-4H3/t11-,12-,14-,15-/m1/s1 Image of MNXM10002
SMILES (mnx)[CH2:1]=[C:10]([CH3:2])[C@@H:12]1[CH2:6][CH:7]=[C:13]2[C@H:14]([OH:16])[CH2:8][CH2:5][C@@H:11]([CH3:3])[C@@:15]2([CH3:4])[CH2:9]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:72642
chebi:72642
NJWPLFBOSCSZFA-QHSBEEBCSA-N 		3-deoxycapsidiol
(1R,4R,4aR,6R)-4,4a-dimethyl-6-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalen-1-ol
1beta,4betaH-eremophila-9,11-diene-1-ol
1beta-hydroxy-5-epiaristolochene
4-epi-eremophila-9,11-dien-1beta-ol

sabiork.compound:21116
sabiorkM:21116 		1-beta-Hydroxy-5-epiaristolochene

seed.compound:cpd24531
seedM:cpd24531
NJWPLFBOSCSZFA-QHSBEEBCSA-N 		1beta-hydroxy-5-epiaristolochene
1beta-hydroxyepiaristolochene
3-deoxy-capsidiol
3-deoxycapsidiol

metacyc.compound:CPD-4663
metacycM:CPD-4663
NJWPLFBOSCSZFA-QHSBEEBCSA-N 		3-deoxycapsidiol
1beta-hydroxy-5-epiaristolochene
1beta-hydroxyepiaristolochene

seedM:M_cpd24531 		secondary/obsolete/fantasy identifier