商陆皂甙丙

pro_cas
65931-92-2
pro_cdbregno
CCD01018476
pro_formula
C42 H66 O15
pro_molWeight
810.968

basic_info

Product_Name: 商陆皂甙丙
CAS: 65931-92-2
中文同义词: 商陆皂甙丙
EnglishSynonyms: (3BETA)-3-[[4-O-(BETA-D-GLUCOPYRANOSYL)-BETA-D-XYLOPYRANOSYL]OXY]-23-HYDROXY-30-METHOXY-30-OXOOLEAN-12-EN-28-OIC ACID ; ESCULENTOSIDE C
pro_mdlNumber: MFCD11111464
pro_acceptors: 15
pro_donors: 8
pro_smile: C[C@@]1(CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H]([C@@]5(C)CO)O[C@H]6[C@@H]([C@H]([C@@H](CO6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)O)C)C)[C@@H]2C1)C)C(=O)O)C(=O)OC
InChi: InChI=1S/C42H66O15/c1-37(36(52)53-6)13-15-42(35(50)51)16-14-40(4)21(22(42)17-37)7-8-26-38(2)11-10-27(39(3,20-44)25(38)9-12-41(26,40)5)57-33-31(48)29(46)24(19-54-33)56-34-32(49)30(47)28(45)23(18-43)55-34/h7,22-34,43-49H,8-20H2,1-6H3,(H,50,51)/t22-,23+,24+,25+,26+,27-,28+,29-,30-,31+,32+,33-,34-,37-,38-,39-,40+,41+,42-/m0/s1
InChiKey: InChIKey=NMDFCFOQBAHNPV-RFTJXAPBSA-N

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