GCIS
GlobalChemical Inventory Search
Panaxatriol
人參三醇, (20R)-Panaxatriol, Panoxatriol, Dammarane-3,6,12-triol, 20,25-epoxy-, (3β,6β,12β,20R)-, Panaxatriol, DAMMARANE-3BETA,6BETA,12BETA-20,25-EPOXYTRIOL, PANAXADIOL(SH), Panaxtriol, HYDROXYPANAXIDIOL, (3β,6β,12β,20R)-20,25-Epoxydammarane-3,6,12-triol
CAS Number: 32791-84-7
IUPAC name: (3S,5R,6R,8R,9R,10R,12R,13R,14R,17S)-4,4,8,10,14-pentamethyl-17-[(2R)-2,6,6-trimethyloxan-2-yl]-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,6,12-triol
Molecular formula: C30H52O4
Molecular weight: 476.732
InChI: InChI=1S/C30H52O4/c1-25(2)12-9-13-30(8,34-25)18-10-15-28(6)23(18)19(31)16-21-27(5)14-11-22(33)26(3,4)24(27)20(32)17-29(21,28)7/h18-24,31-33H,9-17H2,1-8H3/t18-,19+,20+,21+,22-,23-,24-,27+,28+,29+,30+/m0/s1
InChIKey: QFJUYMMIBFBOJY-UXZRXANASA-N
SMILES: C[C@@]1(CCCC(O1)(C)C)[C@H]2CC[C@@]3([C@@H]2[C@@H](C[C@H]4[C@]3(C[C@H]([C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)O)C)O)C
EINECS: -
