AIDS-123009

Molecular Formula: C₆₅H₈₀Cl₂O₁₂

InChI: InChI=1/C65H80Cl2O12/c1-35(2)12-10-13-36(3)51-18-19-52-46-17-16-44-26-37(20-22-64(44,4)53(46)21-23-65(51,52)5)14-11-15-45(40-31-42(56(76-6)49(33-40)62(72)73)24-38-27-47(60(68)69)58(78-8)54(66)29-38)41-32-43(57(77-7)50(34-41)63(74)75)25-39-28-48(61(70)71)59(79-9)55(67)30-39/h15,27-37,44,46,51-53H,10-14,16-26H2,1-9H3,(H,68,69)(H,70,71)(H,72,73)(H,74,75)/t36-,37+,44+,46+,51-,52+,53+,64+,65-/m1/s1/f/h68,70,72,74H

InChIKey: InChIKey=OWPKMQGARJOKHI-CULICYCBDE
SMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)CCC=C(C5=CC(=C(C(=C5)CC6=CC(=C(C(=C6)C(=O)O)OC)Cl)OC)C(=O)O)C7=CC(=C(C(=C7)CC8=CC(=C(C(=C8)C(=O)O)OC)Cl)OC)C(=O)O)C)C

Names:
    AIDS-123009
    AIDS123009
    5-[1-[3-carboxy-5-[(3-carboxy-5-chloro-4-methoxy-phenyl)methyl]-4-methoxy-phenyl]-4-[(3S,5S,8S,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]but-1-enyl]-3-[(3-carboxy-5-chloro-4-methoxy-phenyl)methyl]-2-methoxy-benzoic acid
    5-{[5-((1E)-4-[14-((1R)-1,5-Dimethylhexyl)(2S,5R,14R,15R)-2,15-dimethyltetracyclo[8.7.0.0<2,7>.0<11,15>]heptadec-5-yl]-1-{3-carboxy-5-[(3-carboxy-5-chloro-4-methoxyphenyl)methyl]-4-methoxyphenyl

Registries:
    PubChem CID 493546
    PubChem ID 219375