CAS Number
Molecular Formula
C40H42N4O10S
Product format
Neat
Molecular Weight
770.85
Shipping
Room Temperature
API Family
Synonyms
Ecteinascidin 770; 114899-80-8; [(1R, 2R, 3R, 11S, 12R, 14R, 26R)-12-cyano-5, 6'-dihydroxy-6, 7'-dimethoxy-7, 21, 30-trimethyl-27-oxospiro[17, 19, 28-trioxa-24-thia-13, 30-diazaheptacyclo[12.9.6.13, 11.02, 13.04, 9.015, 23.016, 20]triaconta-4(9), 5, 7, 15, 20, 22-hexaene-26, 1'-3, 4-dihydro-2H-isoquinoline]-22-yl] acetate; ((1R, 2R, 3R, 11S, 12R, 14R, 26R)-12-cyano-5, 6'-dihydroxy-6, 7'-dimethoxy-7, 21, 30-trimethyl-27-oxospiro(17, 19, 28-trioxa-24-thia-13, 30-diazaheptacyclo(12.9.6.13, 11.02, 13.04, 9.015, 23.016, 20)triaconta-4(9), 5, 7, 15, 20, 22-hexaene-26, 1'-3, 4-dihydro-2H-isoquinoline)-22-yl) acetate; RefChem:136270; ((1R, 2R, 12R, 14R, 26R)-12-cyano-5, 6'-dihydroxy-6, 7'-dimethoxy-7, 21, 30-trimethyl-27-oxospiro(17, 19, 28-trioxa-24-thia-13, 30-diazaheptacyclo(12.9.6.13, 11.02, 13.04, 9.015, 23.016, 20)triaconta-4(9), 5, 7, 15, 20, 22-hexaene-26, 1'-3 and 4-dihydro-2H-isoquinoline)-22-yl) acetate; Ecteinascidin 770; Ecteinascidin770; CHEMBL448144; orb1709800; SCHEMBL9765335; SCHEMBL29711393; BGFXHQYUWCGGLL-QWIBJBKUSA-N; AKOS040733065; CS-6236; MS-31394; HY-101191; F85510
Iupac Name
[(1R, 2R, 3R, 11S, 12R, 14R, 26R)-12-cyano-5, 6'-dihydroxy-6, 7'-dimethoxy-7, 21, 30-trimethyl-27-oxospiro[17, 19, 28-trioxa-24-thia-13, 30-diazaheptacyclo[12.9.6.13, 11.02, 13.04, 9.015, 23.016, 20]triaconta-4(9), 5, 7, 15, 20, 22-hexaene-26, 1'-3 and 4-dihydro-2H-isoquinoline]-22-yl] acetate
InChI
InChI=1S/C40H42N4O10S/c1-17-9-21-10-23-24(13-41)44-25-14-51-39(48)40(22-12-27(49-5)26(46)11-20(22)7-8-42-40)15-55-38(32(44)31(43(23)4)28(21)33(47)34(17)50-6)30-29(25)37-36(52-16-53-37)18(2)35(30)54-19(3)45/h9,11-12,23-25,31-32,38,42,46-47H,7-8,10,14-16H2,1-6H3/t23-,24-,25-,31+,32+,38+,40+/m0/s1
