escin Ia
chemical compound
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escin Ia
Summary
escin Ia is a group of stereoisomers[1].
Key Facts
- escin Ia's instance of is recorded as group of stereoisomers[2].
- escin Ia's CAS Registry Number is recorded as 6805-41-0[3].
- escin Ia's EC number is recorded as 229-880-6[4].
- escin Ia's canonical SMILES is recorded as CC=C(C)C(=O)OC1C(C2(C(CC1(C)C)C3=CCC4C5(CCC(C(C5CCC4(C3(CC2O)C)C)(C)CO)OC6C(C(C(C(O6)C(=O)O)OC7C(C(C(C(O7)CO)O)O)O)O)OC8C(C(C(C(O8)CO)O)O)O)C)CO)OC(=O)C[5].
- escin Ia's InChI is recorded as InChI=1S/C55H86O24/c1-10-23(2)46(71)79-43-44(72-24(3)60)55(22-59)26(17-50(43,4)5)25-11-12-30-51(6)15-14-32(52(7,21-58)29(51)13-16-53(30,8)54(25,9)18-31(55)61)75-49-41(77-48-38(67)36(65)34(63)28(20-57)74-48)39(68)40(42(78-49)45(69)70)76-47-37(66)35(64)33(62)27(19-56)73-47/h10-11,26-44,47-49,56-59,61-68H,12-22H2,1-9H3,(H,69,70)[6].
- escin Ia's InChIKey is recorded as AXNVHPCVMSNXNP-UHFFFAOYSA-N[7].
- escin Ia's chemical formula is recorded as C₅₅H₈₆O₂₄[8].
- escin Ia's subclass of is recorded as oleanane triterpenoid[9].
- escin Ia's MeSH descriptor ID is recorded as D004928[10].
- escin Ia's UNII is recorded as RUU8G67GQM[11].
- escin Ia's ChemSpider ID is recorded as 3748910[12].
- escin Ia's PubChem CID is recorded as 4555259[13].
- escin Ia's MeSH tree code is recorded as D02.455.849.919.530.333[14].
- escin Ia's MeSH tree code is recorded as D09.408.782.250[15].
- escin Ia's found in taxon is recorded as Aesculus hippocastanum[16].
- escin Ia's found in taxon is recorded as Aesculus chinensis[17].
- escin Ia's found in taxon is recorded as Aesculus turbinata[18].
- escin Ia's Human Metabolome Database ID is recorded as HMDB0248036[19].
- escin Ia's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+1130.550904'}[20].
- escin Ia's ECHA Substance Infocard ID is recorded as 100.027.164[21].
- escin Ia's SureChEMBL ID is recorded as 167245[22].
- escin Ia's RxNorm CUI is recorded as 4065[23].
- escin Ia's active ingredient in is recorded as aescin[24].
- escin Ia's UniChem compound ID is recorded as 27125026[25].
- escin Ia's Probes And Drugs ID is recorded as PD055236[26].