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前杯苋甾酮
Precyasterone
Stigmast-7-ene-6,26-dione, 22,26-epoxy-2,3,14,20,28-pentahydroxy-, (2β,3β,5β,22R,24S,25S,28R)-, (2β,3β,5β,22R,24S,25S,28R)-2,3,14,20,28-Pentahydroxy-22,26-epoxystigmast-7-ene-6,26-dione, Precyasterone
CAS号: 27335-85-9
IUPAC名称: (3S,4S,6R)-4-[(1R)-1-hydroxyethyl]-6-[(1R)-1-hydroxy-1-[(2S,3R,5R,9R,10R,13R,14S,17S)-2,3,14-trihydroxy-10,13-dimethyl-6-oxo-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethyl]-3-methyloxan-2-one
分子式: C29H44O8
分子量: 520.655
InChI: InChI=1S/C29H44O8/c1-14-16(15(2)30)10-24(37-25(14)34)28(5,35)23-7-9-29(36)18-11-20(31)19-12-21(32)22(33)13-26(19,3)17(18)6-8-27(23,29)4/h11,14-17,19,21-24,30,32-33,35-36H,6-10,12-13H2,1-5H3/t14-,15+,16-,17-,19-,21+,22-,23-,24+,26+,27+,28+,29+/m0/s1
InChIKey: RPCTUYZLPGGPJD-YSEUJXISSA-N
SMILES: C[C@H]1[C@H](C[C@@H](OC1=O)[C@@](C)([C@H]2CC[C@@]3([C@@]2(CC[C@H]4C3=CC(=O)[C@H]5[C@@]4(C[C@@H]([C@@H](C5)O)O)C)C)O)O)[C@@H](C)O
EINECS: -
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