Primary record
Lurbinectedin
- CAS
- 497871-47-3
- PubChem CID
- 57327016
- SMILES
- CC1=CC2=C([C@@H]3[C@@H]4[C@H]5C6=C(C(=C7C(=C6[C@@H](N4[C@H]([C@H](C2)N3C)O)COC(=O)[C@@]8(CS5)C9=C(CCN8)C2=C(N9)C=CC(=C2)OC)OCO7)C)OC(=O)C)C(=C1OC)O
- Molecular Formula
- C41H44N4O10S
- Molecular Weight
- 784.888
- Exact Mass
- 784.2778
- InChI
- InChI=1S/C41H44N4O10S/c1-17-11-20-12-25-39(48)45-26-14-52-40(49)41(38-22(9-10-42-41)23-13-21(50-5)7-8-24(23)43-38)15-56-37(31(45)30(44(25)4)27(20)32(47)33(17)51-6)29-28(26)36-35(53-16-54-36)18(2)34(29)55-19(3)46/h7-8,11,13,25-26,30-31,37,39,42-43,47-48H,9-10,12,14-16H2,1-6H3/t25-,26-,30+,31+,37+,39-,41+/m0/s1
- InChIKey
- YDDMIZRDDREKEP-HWTBNCOESA-N
- LogP
- 4.1889
- TPSA
- 164.28
Names and synonyms
- Lurbinectedin
- Tryptamicidin
- Zepzelca
- zepsyre
- lurbinectedina
- lurbinectedine
- lurbinectedinum
- Lurbinectedin?
- 497871-47-3
- Lurbinectedin [INN]
- PM01183
- 2CN60TN6ZS
- RefChem:56744
- UNII-2CN60TN6ZS
- LURBINECTEDIN [MI]
- PM-01183
- D0V6OA
- Lurbinectedin [USAN:INN]
- LURBINECTEDIN [USAN]
- DTXSID30198065
- PM-1183
- LURBINECTEDIN [WHO-DD]
- PM1183
- orb1308109
- CHEMBL4297516
- PM 01183
- SCHEMBL29362379
- GTPL10681
- DTXCID60120556
- WLZ4516