tpi-287
chemical compound
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tpi-287
Summary
tpi-287 is a group of stereoisomers[1].
Key Facts
- tpi-287's instance of is recorded as group of stereoisomers[2].
- tpi-287's CAS Registry Number is recorded as 849213-15-6[3].
- tpi-287's canonical SMILES is recorded as CC1=C2C(C3C4(C(CC5C(C4C(C(C2(C)C)(CC1OC(=O)C(C(CC(C)C)NC(=O)OC(C)(C)C)O)O)OC(=O)C6=CC=CC=C6)(CO5)OC(=O)C)OC(O3)C=C)C)OC(=O)C[4].
- tpi-287's InChI is recorded as InChI=1S/C46H63NO15/c1-13-32-58-30-20-31-45(22-55-31,61-26(6)49)36-38(60-39(51)27-17-15-14-16-18-27)46(54)21-29(57-40(52)34(50)28(19-23(2)3)47-41(53)62-42(7,8)9)24(4)33(43(46,10)11)35(56-25(5)48)37(59-32)44(30,36)12/h13-18,23,28-32,34-38,50,54H,1,19-22H2,2-12H3,(H,47,53)/t28-,29-,30-,31+,32?,34+,35-,36-,37-,38-,44+,45-,46+/m0/s1[5].
- tpi-287's InChIKey is recorded as FDTAUJJRHBRHIJ-FDJAAIFISA-N[6].
- tpi-287's chemical formula is recorded as C₄₆H₆₃NO₁₅[7].
- tpi-287's subclass of is recorded as chemical compound[8].
- tpi-287's UNII is recorded as A2VM2V569A[9].
- tpi-287's ChemSpider ID is recorded as 9738939[10].
- tpi-287's PubChem CID is recorded as 11564168[11].
- tpi-287's DrugBank ID is recorded as DB17168[12].
- tpi-287's isomeric SMILES is recorded as CC1=C2C@@HOC(=O)CC@HOC(O3)C=">[13].
- tpi-287's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+869.42'}[14].
- tpi-287's SureChEMBL ID is recorded as 10000720[15].
- tpi-287's DSSTox substance ID is recorded as DTXSID50233967[16].
- tpi-287's DSSTOX compound identifier is recorded as DTXCID80156458[17].
- tpi-287's UniChem compound ID is recorded as 33326052[18].