化学式

CAS号

IUPAC Name

(9R,10S,11S,13S,16R,17R)-N-[3-[(2R,5R,6S,7R,8R,9R,11R,14R)-2-乙基-8-[(3R,4S,6R)-4-[乙基(甲基)氨基]-3-羟基-6-methyloxan-2-基]氧基-9-羟基-6-[(4R,5S,6S)-5-羟基-4-甲氧基-4,6-dimethyloxan-2-基]氧基-5,7,9,11,14-五甲基-4,17-二氧代-3,16,18-三氧杂-13-氮杂双环[13.3.0]octadecan-13-基]丙基]-9-氟-11,17-二羟基- (9R,10S,11S,13S,16R,17R)-N-[3-[(2R,5R,6S,7R,8R,9R,11R,14R)-2-ethyl-8-[(3R,4S,6R)-4-[ethyl(methyl)amino]-3-hydroxy-6-methyloxan-2-yl]oxy-9-hydroxy-6-[(4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-5,7,9,11,14-pentamethyl-4,17-dioxo-3,16,18-trioxa-13-azabicyclo[13.3.0]octadecan-13-yl]propyl]-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-17-carboxamide

InChI

InChI=1S/C62H100FN3O17/c1-16-44-50-49(81-56(73)82-50)37(8)66(24-18-23-64-55(72)62(75)33(4)25-42-41-20-19-39-27-40(67)21-22-57(39,10)61(41,63)45(68)29-58(42,62)11)31-32(3)28-59(12,74)52(83-54-47(69)43(65(14)17-2)26-34(5)77-54)35(6)48(36(7)53(71)79-44)80-46-30-60(13,76-15)51(70)38(9)78-46/h21-22,27,32-38,41-52,54,68-70,74-75H,16-20,23-26,28-31H2,1-15H3,(H,64,72)/t32-,33-,34-,35-,36-,37-,38+,41?,42?,43+,44-,45+,46?,47-,48+,49?,50?,51+,52-,54?,57+,58+,59-,60-,61+,62+/m1/s1

InChI Key

CITDPVCBPNDUCC-OKGVASDQSA-N

Canonical SMILES

CCC1C2C(C(N(CC(CC(C(C(C(C(C(=O)O1)C)OC3CC(C(C(O3)C)O)(C)OC)C)OC4C(C(CC(O4)C)N(C)CC)O)(C)O)C)CCCNC(=O)C5(C(CC6C5(CC(C7(C6CCC8=CC(=O)C=CC87C)F)O)C)C)O)C)OC(=O)O2

别名