Chem
J-GLOBAL ID：200907067002977890   Nikkaji number：J451.223E

Arvensoside B

アベロソシドA
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C42H68O13
Molecular formula furigana： C42-H68-O13
Molecular weight： 780.993
InChI： InChI=1S/C42H68O13/c1-37(2)14-16-42(36(50)51)17-15-40(6)21(22(42)18-37)8-9-26-39(5)12-11-27(38(3,4)25(39)10-13-41(26,40)7)54-35-32(49)33(29(46)24(20-44)53-35)55-34-31(48)30(47)28(45)23(19-43)52-34/h8,22-35,43-49H,9-20H2,1-7H3,(H,50,51)/t22-,23+,24+,25-,26+,27-,28-,29+,30-,31+,32+,33-,34-,35-,39-,40+,41+,42-/m0/s1
InChI key： KZIQZLSHACGNHX-LWXDAUFYSA-N
SMILES： CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O)[C@H]7O)[C@H]6O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)O
Systematic name  (5)：
  • 3β-[3-O-(β-D-ガラクトピラノシル)-β-D-グルコピラノシルオキシ]オレアナ-12-エン-28-酸
  • 3β-(3-O-β-D-ガラクトピラノシル-β-D-グルコピラノシルオキシ)オレアナ-12-エン-28-酸
  • 3β-[(3-O-β-D-ガラクトピラノシル-β-D-グルコピラノシル)オキシ]オレアナ-12-エン-28-酸
  • (4aS,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-{[(2R,3R,4S,5R,6R)-3,5-ジヒドロキシ-6-(ヒドロキシメチル)-4-{[(2S,3R,4S,5R,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}オキサン-2-イル]オキシ}-2,2,6a,6b,9,9,12a-ヘプタメチル-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-イコサヒドロピセン-4a-カルボン酸
  • (4aS,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-{[(2R,3R,4S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid
Other name (7)：
  • 3β-[3-O-(β-D-Galactopyranosyl)-β-D-glucopyranosyloxy]olean-12-en-28-oic acid
  • アルベンソシドB
  • Arvensoside B
  • 3β-(3-O-β-D-Galactopyranosyl-β-D-glucopyranosyloxy)oleana-12-ene-28-oic acid
  • アベロソシドA
Show all
CAS registry number： 58232-00-1
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM