Try beta.chemspider
- 10 of 10 defined stereocentres
N-Acetyl-3-(1-naphthyl)-D-alanyl-4-chloro-D-phenylalanyl-3-(3-pyridinyl)-D-alanyl-L-seryl-N-methyl-L-tyrosyl-D-asparaginyl-L-leucyl-N~6~-isopropyl-L-lysyl-L-prolyl-D-alaninamide
C[C@H](C(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(=O)N)NC(=O)[C@H](Cc2ccc(cc2)O)N(C)C(=O)[C@H](CO)NC(=O)[C@@H](Cc3cccnc3)NC(=O)[C@@H](Cc4ccc(cc4)Cl)NC(=O)[C@@H](Cc5cccc6c5cccc6)NC(=O)C
InChI=1S/C72H95ClN14O14/c1-41(2)33-54(64(93)80-53(20-10-11-31-77-42(3)4)72(101)87-32-14-21-60(87)69(98)78-43(5)63(75)92)81-68(97)58(38-62(74)91)84-70(99)61(36-46-24-28-51(90)29-25-46)86(7)71(100)59(40-88)85-66(95)56(35-47-15-13-30-76-39-47)83-65(94)55(34-45-22-26-50(73)27-23-45)82-67(96)57(79-44(6)89)37-49-18-12-17-48-16-8-9-19-52(48)49/h8-9,12-13,15-19,22-30,39,41-43,53-61,77,88,90H,10-11,14,20-21,31-38,40H2,1-7H3,(H2,74,91)(H2,75,92)(H,78,98)(H,79,89)(H,80,93)(H,81,97)(H,82,96)(H,83,94)(H,84,99)(H,85,95)/t43-,53+,54+,55-,56-,57-,58-,59+,60+,61+/m1/s1
IPRLTGDZJQKKGT-HSPKUQOVSA-N
CSID:17326863, http://www.chemspider.com/Chemical-Structure.17326863.html (accessed 20:07, Apr 26, 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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