CAS: 65312-86-9; (2S,3S,4S,5R,6R)-4-(((2S,3R,4S,5R,6R)-4,5-Dihydroxy-6-(Hydroxymethyl)-3-(((2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyltetrahydro-2H-Pyran-2-yl)Oxy)Tetrahydro-2H-Pyran-2-yl)Oxy)-3-Hydroxy-6-(((3S,4Ar,6Ar,6Bs,8R,8As,12Ar,12Bs,14Ar,14Br)-8-Hydroxy-4,4,6A,6B,11,11,14B-Heptamethyloctadecahydro-1H,9H-12B,8A-(Epoxymethano)Picen-3-yl)Oxy)-5-(((2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-yl)Oxy)Tetrahydro-2H-Pyran-2-Carboxylic Acid

该化合物是许多沙邦的特征.由于其性质复杂,Primulasaponin 也可能会与细胞膜发生相互作用,影响渗透性和细胞过程.然而,为了充分阐明其行动和治疗潜力机制,必须进行进一步研究.与许多自然产品一样,提取和净化过程可以极大地影响其生物活动性和稳定性.

英文名称(2S,3S,4S,5R,6R)-4-(((2S,3R,4S,5R,6R)-4,5-Dihydroxy-6-(Hydroxymethyl)-3-(((2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyltetrahydro-2H-Pyran-2-yl)Oxy)Tetrahydro-2H-Pyran-2-yl)Oxy)-3-Hydroxy-6-(((3S,4Ar,6Ar,6Bs,8R,8As,12Ar,12Bs,14Ar,14Br)-8-Hydroxy-4,4,6A,6B,11,11,14B-Heptamethyloctadecahydro-1H,9H-12B,8A-(Epoxymethano)Picen-3-yl)Oxy)-5-(((2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-yl)Oxy)Tetrahydro-2H-Pyran-2-Carboxylic Acid
中文名称报春花皂苷1
IUPAC名称(2S,3S,4S,5R,6R)-4-(((2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-3-hydroxy-6-(((3S,4aR,6aR,6bS,8R,8aS,12aR,12bS,14aR,14bR)-8-hydroxy-4,4,6a,6b,11,11,14b-heptamethyloctadecahydro-1H,9H-12b,8a-(epoxymethano)picen-3-yl)oxy)-5-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-carboxylic acid
其它别名Primulasaponin 1; Primulasaponin I; Saponin Ps 4 From Primula Elatior; Primulic Acid I; β-D-Glucopyranosiduronic Acid, (3β,16α)-13,28-Epoxy-16-Hydroxyoleanan-3-Yl O-6-Deoxy-α-L-Mannopyranosyl-(1→2)-O-β-D-Galactopyranosyl-(1→3)-O-[β-D-Glucopyranosyl-(1→2)]-; Primulic Acid I-Rm
CAS编号65312-86-9
MFCD编号:MFCD08460274
EINECS号:683-196-6
分子式:C54H88O23分子量:1105.28
产品CID: 1635554
产品分类生物化工 → 提取物 → 植物提取物

相似结构搜索
产品信息参考;;;;
InChIKey: DQUUSJCGJNQFPG-CBMAJASRSA-N
InChI=1S/C54H88O23/c1-22-30(58)33(61)36(64)44(70-22)76-41-35(63)32(60)24(20-56)72-46(41)74-39-38(66)40(43(67)68)75-47(42(39)77-45-37(65)34(62)31(59)23(19-55)71-45)73-29-1
计算化学: 氢键受体数23.0氢键供体数13.0可旋转键数11.0

MSDS等安全信息

GHS象形图
GHS符号GHS06;
注释: Skull and crossbones
危险类别急性毒性类别3(经口)
警示词Danger(危险)
危险描述H301 |吞咽会中毒.
防范说明P264-P270-P301+P310-P321-P330-P405-P501
WGK Germany3

欧盟法规

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海关参考信息

2905122000-异丙醇
2905143000-叔丁醇
2905310000-1,2-乙二醇
2905320000-1,2-丙二醇
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合成参考文献

参考文献:10.1038/nchembio.1591
摘要:Meesters C, Mönig T, Oeljeklaus J, Krahn D, Westfall CS, Hause B, Jez JM, Kaiser M, Kombrink E. A chemical inhibitor of jasmonate signaling targets JAR1 in Arabidopsis thaliana. Nat Chem Biol. 2014 Oct;10(10):830–6. doi: 10.1038/nchembio.1591.
参考文献:10.1021/np50087a019
摘要:Çalis I, Yürüker A, Rüegger H, Wright AD, Sticher O. Triterpene Saponins from Primula veris Subsp. macrocalyx and Primula elatior Subsp. meyeri. J. Nat. Prod. 1992 Sep;55(9):1299–306. doi: 10.1021/np50087a019.