(3r)-3-[3-(dimethylamino)propyl-dihydroxy-tetrakis[(1r)-1-hydroxyethyl]-[(4-hydroxyphenyl)methyl]-isopropyl-methyl-tridecaoxo-tridecyl-[?]yl]-3-hydroxy-propanamide

Structural Information

Molecular Formula

C₇₃H₁₂₀N₁₄O₂₃

SMILES

CCCCCCCCCCCCC[C@@H]1CC(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N2C[C@@H](C[C@H]2C(=O)N[C@@H](C(=O)N[C@H](C(=O)N3CC[C@@H]([C@H]3C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C(=O)N[C@H](C(=O)O1)CCCN(C)C)[C@@H](C)O)[C@@H](CC(=O)N)O)O)[C@@H](C)O)[C@@H](C)O)O)C(C)C)CC4=CC=C(C=C4)O)C)[C@@H](C)O

InChI

InChI=1S/C73H120N14O23/c1-11-12-13-14-15-16-17-18-19-20-21-23-47-34-54(97)79-57(40(5)88)67(103)76-39(4)63(99)78-49(32-44-25-27-45(92)28-26-44)64(100)81-56(38(2)3)71(107)87-37-46(93)33-50(87)65(101)82-59(42(7)90)69(105)83-60(43(8)91)72(108)86-31-29-51(94)62(86)70(106)84-61(52(95)35-53(74)96)66(102)75-36-55(98)80-58(41(6)89)68(104)77-48(73(109)110-47)24-22-30-85(9)10/h25-28,38-43,46-52,56-62,88-95H,11-24,29-37H2,1-10H3,(H2,74,96)(H,75,102)(H,76,103)(H,77,104)(H,78,99)(H,79,97)(H,80,98)(H,81,100)(H,82,101)(H,83,105)(H,84,106)/t39-,40-,41-,42-,43-,46-,47-,48+,49+,50+,51+,52-,56+,57-,58-,59-,60+,61+,62+/m1/s1

InChIKey

RZWQMVHIFHIRPW-GLHVTYCWSA-N

Compound name

(3R)-3-[(3S,6R,9S,11R,15S,18S,21R,24R,28R,31S,34R,40S,43S,44S)-31-[3-(dimethylamino)propyl]-11,44-dihydroxy-3,6,24,34-tetrakis[(1R)-1-hydroxyethyl]-18-[(4-hydroxyphenyl)methyl]-21-methyl-2,5,8,14,17,20,23,26,30,33,36,39,42-tridecaoxo-15-propan-2-yl-28-tridecyl-29-oxa-1,4,7,13,16,19,22,25,32,35,38,41-dodecazatricyclo[41.3.0.09,13]hexatetracontan-40-yl]-3-hydroxypropanamide

Related CIDs

• CID 485144