Try beta.chemspider
- 10 of 10 defined stereocentres
N-Acetyl-3-(2-naphthyl)-D-alanyl-4-chloro-D-phenylalanyl-3-(3-pyridinyl)-D-alanyl-L-seryl-L-tyrosyl-N~5~-carbamoyl-D-ornithyl-3-methyl-L-valyl-L-arginyl-L-prolyl-D-alaninamide
[H]/N=C(\N)/NCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)N)NC(=O)[C@H](C(C)(C)C)NC(=O)[C@@H](CCCNC(=O)N)NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc3cccnc3)NC(=O)[C@@H](Cc4ccc(cc4)Cl)NC(=O)[C@@H](Cc5ccc6ccccc6c5)NC(=O)C
InChI=1S/C70H92ClN17O14/c1-39(58(72)92)79-65(99)56-17-11-31-88(56)67(101)50(16-10-29-77-68(73)74)82-66(100)57(70(3,4)5)87-59(93)49(15-9-30-78-69(75)102)81-61(95)52(34-42-21-26-48(91)27-22-42)85-64(98)55(38-89)86-63(97)54(36-44-12-8-28-76-37-44)84-62(96)53(33-41-19-24-47(71)25-20-41)83-60(94)51(80-40(2)90)35-43-18-23-45-13-6-7-14-46(45)32-43/h6-8,12-14,18-28,32,37,39,49-57,89,91H,9-11,15-17,29-31,33-36,38H2,1-5H3,(H2,72,92)(H,79,99)(H,80,90)(H,81,95)(H,82,100)(H,83,94)(H,84,96)(H,85,98)(H,86,97)(H,87,93)(H4,73,74,77)(H3,75,78,102)/t39-,49-,50+,51-,52+,53-,54-,55+,56+,57-/m1/s1
GBONOJLAYCGCKZ-CNXOCHLTSA-N
CSID:17326031, http://www.chemspider.com/Chemical-Structure.17326031.html (accessed 04:30, 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
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