23-O-Acetylshengmanol-3-O-beta-D-xylopyranoside


CAS No. : 62498-88-8

23-O-Acetylshengmanol-3-O-beta-D-xylopyranoside,62498-88-8
Product Details
Cat No:R074719
Molecular Formula:C37H58O10
Molecular Weight:662.8
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Cat No:R074719
Cas No:62498-88-8
Product-Name:23-O-Acetylshengmanol-3-O-beta-D-xylopyranoside
IUPAC Name:[(1R,3R)-1-[(2S)-3,3-dimethyloxiran-2-yl]-3-[(1S,3R,6S,8R,11R,12S,13R,15R,16R)-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]butyl] acetate
InChI:InChI=1S/C37H58O10/c1-18(15-21(45-19(2)38)30-33(5,6)47-30)25-27(41)29(43)35(8)23-10-9-22-32(3,4)24(46-31-28(42)26(40)20(39)16-44-31)11-12-36(22)17-37(23,36)14-13-34(25,35)7/h18,20-26,28-31,39-40,42-43H,9-17H2,1-8H3/t18-,20-,21-,22+,23+,24+,25+,26+,28-,29+,30+,31+,34-,35-,36-,37+/m1/s1
InChIKey:IHEJMZHKJYHVFF-JUKRZFGDSA-N
SMILES:CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)C)C)O

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