Try beta.chemspider
- 15 of 16 defined stereocentres
2-(4-Biphenylyloxy)-N-{(2R,6S,9R,11R,12S,14aS,15S,16S,20S,23S,25aS)-23-[(1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl]-2,11,12,15-tetrahydroxy-6,20-bis[(1R)-1-hydroxyethyl]-16-methyl-5,8,14,19,22,25- hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2',1'-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl}hexanamide
CCCCC(C(=O)N[C@@H]1C[C@H]([C@@H](NC(=O)[C@@H]2[C@H]([C@H](CN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@@H](NC1=O)[C@@H](C)O)O)[C@@H]([C@H](c4ccc(cc4)O)O)O)[C@@H](C)O)C)O)O)O)Oc5ccc(cc5)c6ccccc6
InChI=1S/C52H69N7O17/c1-5-6-12-37(76-33-19-15-29(16-20-33)28-10-8-7-9-11-28)48(71)53-34-22-36(64)47(70)57-50(73)41-42(65)25(2)23-59(41)52(75)39(27(4)61)55-49(72)40(44(67)43(66)30-13-17-31(62)18-14-30)56-46(69)35-21-32(63)24-58(35)51(74)38(26(3)60)54-45(34)68/h7-11,13-20,25-27,32,34-44,47,60-67,70H,5-6,12,21-24H2,1-4H3,(H,53,71)(H,54,68)(H,55,72)(H,56,69)(H,57,73)/t25-,26+,27+,32+,34+,35-,36+,37?,38-,39-,40-,41-,42-,43-,44-,47-/m0/s1
QAFLCRPTOZYECX-DMNSFVEOSA-N
CSID:13101783, http://www.chemspider.com/Chemical-Structure.13101783.html (accessed 21:52, Apr 25, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
Advertisement
Spotlight