Desacetylvinblastine
chemical compound
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Desacetylvinblastine
Summary
Desacetylvinblastine is a group of stereoisomers[1].
Key Facts
- Desacetylvinblastine's instance of is recorded as group of stereoisomers[2].
- Desacetylvinblastine's CAS Registry Number is recorded as 3352-69-0[3].
- Desacetylvinblastine's canonical SMILES is recorded as O=C(OC)C1(O)C(O)C2(C=CCN3CCC4(C5=CC(=C(OC)C=C5N(C)C14)C6(C(=O)OC)C=7NC=8C=CC=CC8C7CCN9CC(CC(O)(C9)CC)C6)C32)CC[4].
- Desacetylvinblastine's InChI is recorded as InChI=1S/C44H56N4O8/c1-7-40(52)22-26-23-43(38(50)55-5,34-28(14-18-47(24-26)25-40)27-12-9-10-13-31(27)45-34)30-20-29-32(21-33(30)54-4)46(3)36-42(29)16-19-48-17-11-15-41(8-2,35(42)48)37(49)44(36,53)39(51)56-6/h9-13,15,20-21,26,35-37,45,49,52-53H,7-8,14,16-19,22-25H2,1-6H3/t26-,35+,36-,37-,40+,41-,42?,43+,44+/m1/s1[5].
- Desacetylvinblastine's InChIKey is recorded as NDMPLJNOPCLANR-SAYSVMKTSA-N[6].
- Desacetylvinblastine's chemical formula is recorded as C₄₄H₅₆N₄O₈[7].
- Desacetylvinblastine's subclass of is recorded as chemical compound[8].
- Desacetylvinblastine's PubChem CID is recorded as 197026[9].
- Desacetylvinblastine's ChEBI ID is recorded as 172822[10].
- Desacetylvinblastine's found in taxon is recorded as Catharanthus roseus[11].
- Desacetylvinblastine's isomeric SMILES is recorded as CC[C@]1(O)C[C@H]2CN(CCc3c([nH]c4ccccc34)C@@(c3cc4c(cc3OC)N(C)[C@@H]3C45CCN4CC=CC@([C@H]45)C@@H[C@]3(O)C(=O)OC)C2)C1C@@(c3cc4c(cc3OC)N(C)[C@@H]3C45CCN4CC=CC@([C@H]45)C@@H[C@]3(O)C(=O)OC)C2)C1">[12].
- Desacetylvinblastine's KNApSAcK ID is recorded as C00061481[13].
- Desacetylvinblastine's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+768.409814752'}[14].
- Desacetylvinblastine's SureChEMBL ID is recorded as 29663059[15].
- Desacetylvinblastine's DSSTox substance ID is recorded as DTXSID60955143[16].
- Desacetylvinblastine's DSSTOX compound identifier is recorded as DTXCID701383145[17].
- Desacetylvinblastine's UniChem compound ID is recorded as 44056784[18].