化学式

CAS号

IUPAC Name

S-[2-[[(3aR,4R,6aR)-4-[4-[[双(4-甲氧基苯基)-苯基甲基]氨基]-2-氧代嘧啶-1-基]-3a-甲基-2-氧代-6,6a-二氢-4H-呋喃并[3,4-d][1,3]二氧杂环戊烯-6-基]甲氧基-(苄基氨基)phosphoryl]oxyethyl]2,2-dimethylbutanethioate S-[2-[[(3aR,4R,6aR)-4-[4-[[bis(4-methoxyphenyl)-phenylmethyl]amino]-2-oxopyrimidin-1-yl]-3a-methyl-2-oxo-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methoxy-(benzylamino)phosphoryl]oxyethyl] 2,2-dimethylbutanethioate

InChI

InChI=1S/C47H53N4O11PS/c1-7-45(2,3)42(52)64-29-28-58-63(55,48-30-32-14-10-8-11-15-32)59-31-38-40-46(4,62-44(54)61-40)41(60-38)51-27-26-39(49-43(51)53)50-47(33-16-12-9-13-17-33,34-18-22-36(56-5)23-19-34)35-20-24-37(57-6)25-21-35/h8-27,38,40-41H,7,28-31H2,1-6H3,(H,48,55)(H,49,50,53)/t38?,40-,41-,46-,63?/m1/s1

InChI Key

DIYGZXYXHWYRCS-LTWIOHHBSA-N

Canonical SMILES

CCC(C)(C)C(=O)SCCOP(=O)(NCC1=CC=CC=C1)OCC2C3C(C(O2)N4C=CC(=NC4=O)NC(C5=CC=CC=C5)(C6=CC=C(C=C6)OC)C7=CC=C(C=C7)OC)(OC(=O)O3)C

别名

• SCHEMBL16021600