(3R,4S,4Ar,6As,6Br,8Ar,9S,10S,12Ar,12Br,14Bs)-9-(Hydroxymethyl)-2,2,4A,6A,6B,9,12A-Heptamethyl-1,2,3,4,4A,5,6,6A,6B,7,8,8A,9,10,11,12,12A,12B,13,14B-Icosahydropicene-3,4,10-Triol (3R,4S,4aR,6aS,6bR,8aR,9S,10S,12aR,12bR,14bS)-9-(羟甲基)-2,2,4a,6a,6b,9,12a-七甲基-1,2,3,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-二十氢苉-3,4,10-三醇

CAS 508-01-0 MFCD00075987

化学结构图

508-01-0
SMILES: CC1(C)C[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C)[C@H](O)[C@@H]1O

化学属性

Mol. FormulaC30H50O4
Mol. Weight475
Melting Point308-312

别名和识别编码

Chemical Name(3R,4S,4Ar,6As,6Br,8Ar,9S,10S,12Ar,12Br,14Bs)-9-(Hydroxymethyl)-2,2,4A,6A,6B,9,12A-Heptamethyl-1,2,3,4,4A,5,6,6A,6B,7,8,8A,9,10,11,12,12A,12B,13,14B-Icosahydropicene-3,4,10-Triol
Synonym (3BETA,4BETA,21BETA,22BETA)-OLEAN-12-ENE-3,21,22,23-TETROL olean-12-ene-3,21,22,23-tetrol soyasapogenol A
Chemical Name Translation(3R,4S,4aR,6aS,6bR,8aR,9S,10S,12aR,12bR,14bS)-9-(羟甲基)-2,2,4a,6a,6b,9,12a-七甲基-1,2,3,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-二十氢苉-3,4,10-三醇
MDL NumberN/A
CAS Number508-01-0
LabNetwork Molecule IDLN04679014
PubChem Substance ID12442849
InChIInChI=1S/C30H50O4/c1-25(2)16-19-18-8-9-21-27(4)12-11-22(32)28(5,17-31)20(27)10-13-30(21,7)29(18,6)15-14-26(19,3)24(34)23(25)33/h8,19-24,31-34H,9-17H2,1-7H3/t19-,20+,21+,22-,23-,24+,26+,27-,28+,29+,30+/m0/s1
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安全信息

GHS Symbol
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
Precautionary statements
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛，皮肤或衣服。

系列性分类

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