Bleomycin
group of stereoisomers with the chemical formula C₅₅H₈₄N₁₇O₂₁S₃⁺
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Bleomycin
Summary
Bleomycin is a group of stereoisomers[1].
Key Facts
- Bleomycin's instance of is recorded as group of stereoisomers[2].
- Bleomycin's canonical SMILES is recorded as Cc1c(C(=O)NC(C(=O)NC(C)C(O)C(C)C(=O)NC(C(=O)NCCc2nc(-c3nc(C(=O)NCCCS+C)cs3)cs2)C(C)O)C(OC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C(OC(N)=O)C2O)c2cnc[nH]2)nc(C(CC(N)=O)NCC(N)C(N)=O)[nH]c1=NS+C)cs3)cs2)C(C)O)C(OC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C(OC(N)=O)C2O)c2cnc[nH]2)nc(C(CC(N)=O)N">[3].
- Bleomycin's InChI is recorded as InChI=1S/C55H83N17O21S3/c1-20-33(69-46(72-44(20)58)25(12-31(57)76)64-13-24(56)45(59)82)50(86)71-35(41(26-14-61-19-65-26)91-54-43(39(80)37(78)29(15-73)90-54)92-53-40(81)42(93-55(60)88)38(79)30(16-74)89-53)51(87)66-22(3)36(77)21(2)47(83)70-34(23(4)75)49(85)63-10-8-32-67-28(18-94-32)52-68-27(17-95-52)48(84)62-9-7-11-96(5)6/h14,17-19,21-25,29-30,34-43,53-54,64,73-75,77-81H,7-13,15-16,56H2,1-6H3,(H13-,57,58,59,60,61,62,63,65,66,69,70,71,72,76,82,83,84,85,86,87,88)/p+1/t21-,22+,23+,24-,25-,29?,30?,34-,35-,36-,37?,38?,39?,40?,41-,42?,43?,53?,54?/m0/s1[4].
- Bleomycin's InChIKey is recorded as OYVAGSVQBOHSSS-WXFSZRTFSA-O[5].
- Bleomycin's chemical formula is recorded as C₅₅H₈₄N₁₇O₂₁S₃⁺[6].
- Bleomycin's subclass of is recorded as thiazole alkaloid[7].
- Bleomycin's PubChem CID is recorded as 5360373[8].
- Bleomycin's DrugBank ID is recorded as DB00290[9].
- Bleomycin's isomeric SMILES is recorded as Cc1c(C(=O)NC@HC@@Hc2cnc[nH]2)nc(C@HNCC@HC(N)=O)[nH]c1=NC@H[C@@H](OC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C(OC(N)=">[10].
- Bleomycin's Human Metabolome Database ID is recorded as HMDB0014435[11].
- Bleomycin's LIPID MAPS ID is recorded as LMPK14000006[12].
- Bleomycin's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+1414.51843212809'}[13].
- Bleomycin's SureChEMBL ID is recorded as 29492314[14].
- Bleomycin's SureChEMBL ID is recorded as 21090952[15].
- Bleomycin's UniChem compound ID is recorded as 1066012[16].
- Bleomycin's Probes And Drugs ID is recorded as PD010120[17].