(7RS,9S)-pirarubicin
chemical compound
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Summary
(7RS,9S)-pirarubicin is a group of stereoisomers[1].
Key Facts
- (7RS,9S)-pirarubicin's instance of is recorded as group of stereoisomers[2].
- (7RS,9S)-pirarubicin's canonical SMILES is recorded as CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)CO)O)N)OC6CCCCO6[3].
- (7RS,9S)-pirarubicin's InChI is recorded as InChI=1S/C32H37NO12/c1-14-31(45-21-8-3-4-9-42-21)17(33)10-22(43-14)44-19-12-32(40,20(35)13-34)11-16-24(19)30(39)26-25(28(16)37)27(36)15-6-5-7-18(41-2)23(15)29(26)38/h5-7,14,17,19,21-22,31,34,37,39-40H,3-4,8-13,33H2,1-2H3/t14-,17-,19?,21+,22-,31+,32-/m0/s1[4].
- (7RS,9S)-pirarubicin's InChIKey is recorded as KMSKQZKKOZQFFG-YHKVCKOMSA-N[5].
- (7RS,9S)-pirarubicin's chemical formula is recorded as C₃₂H₃₇NO₁₂[6].
- (7RS,9S)-pirarubicin's subclass of is recorded as chemical compound[7].
- (7RS,9S)-pirarubicin's ChEMBL ID is recorded as CHEMBL40848[8].
- (7RS,9S)-pirarubicin's ChemSpider ID is recorded as 2298189[9].
- (7RS,9S)-pirarubicin's PubChem CID is recorded as 3033521[10].
- (7RS,9S)-pirarubicin's isomeric SMILES is recorded as C[C@H]1C@HO[C@@H]6CCCCO6C@HO[C@@H]6CCCCO6">[11].
- (7RS,9S)-pirarubicin's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+627.231576'}[12].
- (7RS,9S)-pirarubicin's SureChEMBL ID is recorded as 8324[13].
- (7RS,9S)-pirarubicin's DSSTox substance ID is recorded as DTXSID2046755[14].
- (7RS,9S)-pirarubicin's DSSTOX compound identifier is recorded as DTXCID0026755[15].
- (7RS,9S)-pirarubicin's UniChem compound ID is recorded as 27129976[16].