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Phyllocladan-16alpha-ol

PropertiesImage
MNX_IDMNXM731063 Image of MNXM731063
referencekeggC:C19817
formulaC20H34O
global charge0
mol weight290.491
InChIKeyFZSRMADKTOBCNT-LZHQGQFHSA-N
InChIInChI=1S/C20H34O/c1-17(2)9-5-10-18(3)15(17)8-11-20-12-14(6-7-16(18)20)19(4,21)13-20/h14-16,21H,5-13H2,1-4H3/t14-,15+,16-,18+,19-,20+/m1/s1
SMILESCC1(C)CCC[C@@]2(C)[C@H]1CC[C@@]13C[C@@H](CC[C@@H]12)[C@](C)(O)C3
MNX internals
InChI (mnx)InChI=1/C20H34O/c1-17(2)9-5-10-18(3)15(17)8-11-20-12-14(6-7-16(18)20)19(4,21)13-20/h14-16,21H,5-13H2,1-4H3/t14-,15+,16-,18+,19-,20+/m1/s1 Image of MNXM731063
SMILES (mnx)[CH3:1][C:17]1([CH3:2])[CH2:9][CH2:5][CH2:10][C@@:18]2([CH3:3])[C@H:15]1[CH2:8][CH2:11][C@@:20]13[CH2:12][C@@H:14]([CH2:6][CH2:7][C@H:16]21)[C@:19]([CH3:4])([OH:21])[CH2:13]3
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

kegg.compound:C19817
keggC:C19817
FZSRMADKTOBCNT-LZHQGQFHSA-N
Phyllocladan-16alpha-ol

seed.compound:cpd21060
seedM:cpd21060
FZSRMADKTOBCNT-WLAIHKBOSA-N
Phyllocladan-16alpha-ol
ent-16-a-hydroxy-kaurene
phyllocladan-16alpha-ol

metacyc.compound:CPD-11669
metacycM:CPD-11669
FZSRMADKTOBCNT-WLAIHKBOSA-N
ent-16-a-hydroxy-kaurene
phyllocladan-16alpha-ol

keggC:M_C19817
seedM:M_cpd21060
secondary/obsolete/fantasy identifier