化学式

CAS号

IUPAC Name

2-[[2-[6-[[(S)-[(2R,3R,4S)-3-乙酰氨基-4-(diaminomethylideneamino)-6-甲氧基羰基-3,4-二氢-2H-吡喃-2-基]-(2-氧代-1,3-二氧杂烷-4-基)甲氧基]carbonylamino]己基氨基]-2-氧代乙基]-[2-[[2-[6-[[(S)-[(2R,3R,4S)-3-乙酰氨基-4-(diaminomethylideneamino)-6-甲氧基羰基-3,4-二氢-2H-吡喃-2-基]-(2-氧代-1,3-二氧杂烷-4-基)甲氧基]carb 2-[[2-[6-[[(S)-[(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-6-methoxycarbonyl-3,4-dihydro-2H-pyran-2-yl]-(2-oxo-1,3-dioxolan-4-yl)methoxy]carbonylamino]hexylamino]-2-oxoethyl]-[2-[[2-[6-[[(S)-[(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-6-methoxycarbonyl-3,4-dihydro-2H-pyran-2-yl]-(2-oxo-1,3-dioxolan-4-yl)methoxy]carbonylamino]hexylamino]-2-oxoethyl]-(carboxymethyl)amino]ethyl]amino]acetic acid

InChI

InChI=1S/C52H80N14O24/c1-27(67)61-39-29(63-47(53)54)19-31(45(75)81-3)85-43(39)41(33-25-83-51(79)87-33)89-49(77)59-15-11-7-5-9-13-57-35(69)21-65(23-37(71)72)17-18-66(24-38(73)74)22-36(70)58-14-10-6-8-12-16-60-50(78)90-42(34-26-84-52(80)88-34)44-40(62-28(2)68)30(64-48(55)56)20-32(86-44)46(76)82-4/h19-20,29-30,33-34,39-44H,5-18,21-26H2,1-4H3,(H,57,69)(H,58,70)(H,59,77)(H,60,78)(H,61,67)(H,62,68)(H,71,72)(H,73,74)(H4,53,54,63)(H4,55,56,64)/t29-,30-,33?,34?,39+,40+,41+,42+,43+,44+/m0/s1

InChI Key

MSLKWVQNKJLSTJ-XJFVFNQYSA-N

Canonical SMILES

CC(=O)NC1C(C=C(OC1C(C2COC(=O)O2)OC(=O)NCCCCCCNC(=O)CN(CCN(CC(=O)NCCCCCCNC(=O)OC(C3COC(=O)O3)C4C(C(C=C(O4)C(=O)OC)N=C(N)N)NC(=O)C)CC(=O)O)CC(=O)O)C(=O)OC)N=C(N)N

别名

• SCHEMBL14526683